Pyrrolidines

Organic heterocyclic compounds that consist of a five-membered ring with four carbon atoms and one nitrogen atom that form a cyclic secondary amine.

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1-Cyclohexyl-2-pyrrolidinone, 99%

CAS: 6837-24-7 Molecular Formula: C10H17NO Molecular Weight (g/mol): 167.252 MDL Number: MFCD00003191 InChI Key: PZYDAVFRVJXFHS-UHFFFAOYSA-N Synonym: n-cyclohexyl-2-pyrrolidone,1-cyclohexyl-2-pyrrolidone,2-pyrrolidinone, 1-cyclohexyl,cyclohexyl pyrrolidone,n-cyclohexylpyrrolidone,1-cyclohexyl-2-pyrrolidinone,n-cyclohexylpyrrolidinone,unii-7im8p1vvnm,7im8p1vvnm,acmc-20aj1a PubChem CID: 81278 IUPAC Name: 1-cyclohexylpyrrolidin-2-one SMILES: C1CCC(CC1)N2CCCC2=O

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PubChem CID	81278
CAS	6837-24-7
Molecular Weight (g/mol)	167.252
MDL Number	MFCD00003191
SMILES	C1CCC(CC1)N2CCCC2=O
Synonym	n-cyclohexyl-2-pyrrolidone,1-cyclohexyl-2-pyrrolidone,2-pyrrolidinone, 1-cyclohexyl,cyclohexyl pyrrolidone,n-cyclohexylpyrrolidone,1-cyclohexyl-2-pyrrolidinone,n-cyclohexylpyrrolidinone,unii-7im8p1vvnm,7im8p1vvnm,acmc-20aj1a
IUPAC Name	1-cyclohexylpyrrolidin-2-one
InChI Key	PZYDAVFRVJXFHS-UHFFFAOYSA-N
Molecular Formula	C10H17NO

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(2-Oxo-1-pyrrolidinyl)acetic acid, 97%, Thermo Scientific Chemicals

CAS: 53934-76-2 Molecular Formula: C6H9NO3 Molecular Weight (g/mol): 143.142 MDL Number: MFCD00962836 InChI Key: JGPIWNNFLKDTSR-UHFFFAOYSA-N Synonym: 2-oxo-1-pyrrolidineacetic acid,2-2-oxopyrrolidin-1-yl acetic acid,2-oxopyrrolidin-1-yl acetic acid,2-oxo-pyrrolidin-1-yl-acetic acid,2-oxo-1-pyrrolidinyl acetic acid,1-pyrrolidineacetic acid, 2-oxo,2-2-oxopyrrolidinyl acetic acid,piracetam impuirty d,2-pyrrolidone acetic acid,acmc-209lb1 PubChem CID: 3146687 IUPAC Name: 2-(2-oxopyrrolidin-1-yl)acetic acid SMILES: C1CC(=O)N(C1)CC(=O)O

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PubChem CID	3146687
CAS	53934-76-2
Molecular Weight (g/mol)	143.142
MDL Number	MFCD00962836
SMILES	C1CC(=O)N(C1)CC(=O)O
Synonym	2-oxo-1-pyrrolidineacetic acid,2-2-oxopyrrolidin-1-yl acetic acid,2-oxopyrrolidin-1-yl acetic acid,2-oxo-pyrrolidin-1-yl-acetic acid,2-oxo-1-pyrrolidinyl acetic acid,1-pyrrolidineacetic acid, 2-oxo,2-2-oxopyrrolidinyl acetic acid,piracetam impuirty d,2-pyrrolidone acetic acid,acmc-209lb1
IUPAC Name	2-(2-oxopyrrolidin-1-yl)acetic acid
InChI Key	JGPIWNNFLKDTSR-UHFFFAOYSA-N
Molecular Formula	C6H9NO3

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2-Pyrrolidinone, 99%

CAS: 616-45-5 Molecular Formula: C₄H₇NO Molecular Weight (g/mol): 85.11 MDL Number: MFCD00005270 InChI Key: HNJBEVLQSNELDL-UHFFFAOYSA-N Synonym: 2-pyrrolidinone,pyrrolidone,butyrolactam,2-pyrrolidone,2-oxopyrrolidine,pyrrolidon,2-ketopyrrolidine,2-pyrol,pyrrolidinone,gamma-butyrolactam PubChem CID: 12025 ChEBI: CHEBI:36592 IUPAC Name: pyrrolidin-2-one SMILES: C1CC(=O)NC1

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PubChem CID	12025
CAS	616-45-5
Molecular Weight (g/mol)	85.11
ChEBI	CHEBI:36592
MDL Number	MFCD00005270
SMILES	C1CC(=O)NC1
Synonym	2-pyrrolidinone,pyrrolidone,butyrolactam,2-pyrrolidone,2-oxopyrrolidine,pyrrolidon,2-ketopyrrolidine,2-pyrol,pyrrolidinone,gamma-butyrolactam
IUPAC Name	pyrrolidin-2-one
InChI Key	HNJBEVLQSNELDL-UHFFFAOYSA-N
Molecular Formula	C₄H₇NO

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N-Bromosuccinimide, 99%

CAS: 128-08-5 Molecular Formula: C4H4BrNO2 Molecular Weight (g/mol): 177.985 MDL Number: MFCD00005510 InChI Key: PCLIMKBDDGJMGD-UHFFFAOYSA-N Synonym: n-bromosuccinimide,succinbromimide,succinbromide,succinibromimide,n-bromosuccimide,2,5-pyrrolidinedione, 1-bromo,1-bromo-2,5-pyrrolidinedione,bromosuccinimide,nbs,n-bromo succinimide PubChem CID: 67184 ChEBI: CHEBI:53174 IUPAC Name: 1-bromopyrrolidine-2,5-dione SMILES: C1CC(=O)N(C1=O)Br

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PubChem CID	67184
CAS	128-08-5
Molecular Weight (g/mol)	177.985
ChEBI	CHEBI:53174
MDL Number	MFCD00005510
SMILES	C1CC(=O)N(C1=O)Br
Synonym	n-bromosuccinimide,succinbromimide,succinbromide,succinibromimide,n-bromosuccimide,2,5-pyrrolidinedione, 1-bromo,1-bromo-2,5-pyrrolidinedione,bromosuccinimide,nbs,n-bromo succinimide
IUPAC Name	1-bromopyrrolidine-2,5-dione
InChI Key	PCLIMKBDDGJMGD-UHFFFAOYSA-N
Molecular Formula	C4H4BrNO2

Polyvinylpyrrolidone K 30 Average Molecular Wt. 40,000, TCI America™

CAS: 9003-39-8 Molecular Formula: (C6H9NO)n Molecular Weight (g/mol): 40000 MDL Number: MFCD01076626 InChI Key: WHNWPMSKXPGLAX-UHFFFAOYSA-N Synonym: n-vinyl-2-pyrrolidone,n-vinylpyrrolidone,1-vinyl-2-pyrrolidone,1-vinylpyrrolidin-2-one,n-vinyl-2-pyrrolidinone,vinylpyrrolidone,2-pyrrolidinone, 1-ethenyl,1-vinyl-2-pyrrolidinone,n-vinylpyrrolidinone,1-vinylpyrrolidone PubChem CID: 6917 ChEBI: CHEBI:82551 IUPAC Name: 1-ethenylpyrrolidin-2-one SMILES: *-CC(-*)N1CCCC1=O

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PubChem CID	6917
CAS	9003-39-8
Molecular Weight (g/mol)	40000
ChEBI	CHEBI:82551
MDL Number	MFCD01076626
SMILES	-CC(-)N1CCCC1=O
Synonym	n-vinyl-2-pyrrolidone,n-vinylpyrrolidone,1-vinyl-2-pyrrolidone,1-vinylpyrrolidin-2-one,n-vinyl-2-pyrrolidinone,vinylpyrrolidone,2-pyrrolidinone, 1-ethenyl,1-vinyl-2-pyrrolidinone,n-vinylpyrrolidinone,1-vinylpyrrolidone
IUPAC Name	1-ethenylpyrrolidin-2-one
InChI Key	WHNWPMSKXPGLAX-UHFFFAOYSA-N
Molecular Formula	(C6H9NO)n

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N-Boc-D-beta-proline, 95%, Thermo Scientific Chemicals

CAS: 72925-16-7 Molecular Formula: C10H17NO4 Molecular Weight (g/mol): 215.25 MDL Number: MFCD03094727 InChI Key: HRMRQBJUFWFQLX-UHFFFAOYNA-N Synonym: r-1-n-boc-beta-proline,r-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,r-1-boc-pyrrolidine-3-carboxylic acid,r-1-boc-3-carboxyl pyrrolidine,boc-l-beta-proline,n-boc-d-beta-proline,r-n-boc-pyrrolidine-3-carboxylic acid,r-1-n-boc-pyrrolidine-3-carboxylic acid,3r-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,1,3-pyrrolidinedicarboxylic acid, 1-1,1-dimethylethyl ester, 3r PubChem CID: 1512491 SMILES: CC(C)(C)OC(=O)N1CCC(C1)C(O)=O

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PubChem CID	1512491
CAS	72925-16-7
Molecular Weight (g/mol)	215.25
MDL Number	MFCD03094727
SMILES	CC(C)(C)OC(=O)N1CCC(C1)C(O)=O
Synonym	r-1-n-boc-beta-proline,r-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,r-1-boc-pyrrolidine-3-carboxylic acid,r-1-boc-3-carboxyl pyrrolidine,boc-l-beta-proline,n-boc-d-beta-proline,r-n-boc-pyrrolidine-3-carboxylic acid,r-1-n-boc-pyrrolidine-3-carboxylic acid,3r-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,1,3-pyrrolidinedicarboxylic acid, 1-1,1-dimethylethyl ester, 3r
InChI Key	HRMRQBJUFWFQLX-UHFFFAOYNA-N
Molecular Formula	C10H17NO4

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1-(3-Aminopropyl)pyrrolidine, 97%

CAS: 23159-07-1 Molecular Formula: C7H16N2 Molecular Weight (g/mol): 128.219 MDL Number: MFCD00014100 InChI Key: VPBWZBGZWHDNKL-UHFFFAOYSA-N Synonym: 3-pyrrolidin-1-yl propan-1-amine,1-3-aminopropyl pyrrolidine,1-3-aminopropyl-pyrrolidine,1-pyrrolidinepropanamine,n-3-aminopropyl pyrrolidine,3-pyrrolidinopropylamine,3-1-pyrrolidinyl propylamine,pyrrolidine, 1-3-aminopropyl,3-pyrrolidin-1-ylpropylamine,3-1-pyrrolidino propylamine PubChem CID: 31670 IUPAC Name: 3-pyrrolidin-1-ylpropan-1-amine SMILES: C1CCN(C1)CCCN

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PubChem CID	31670
CAS	23159-07-1
Molecular Weight (g/mol)	128.219
MDL Number	MFCD00014100
SMILES	C1CCN(C1)CCCN
Synonym	3-pyrrolidin-1-yl propan-1-amine,1-3-aminopropyl pyrrolidine,1-3-aminopropyl-pyrrolidine,1-pyrrolidinepropanamine,n-3-aminopropyl pyrrolidine,3-pyrrolidinopropylamine,3-1-pyrrolidinyl propylamine,pyrrolidine, 1-3-aminopropyl,3-pyrrolidin-1-ylpropylamine,3-1-pyrrolidino propylamine
IUPAC Name	3-pyrrolidin-1-ylpropan-1-amine
InChI Key	VPBWZBGZWHDNKL-UHFFFAOYSA-N
Molecular Formula	C7H16N2

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N-Hydroxysuccinimide, 98+%

CAS: 6066-82-6 Molecular Formula: C₄H₅NO₃ Molecular Weight (g/mol): 115.09 MDL Number: MFCD00005516 InChI Key: NQTADLQHYWFPDB-UHFFFAOYSA-N Synonym: n-hydroxysuccinimide,hosu,1-hydroxysuccinimide,2,5-pyrrolidinedione, 1-hydroxy,1-hydroxy-2,5-pyrrolidinedione,succinimide, n-hydroxy,n-hydroxysuccinimde,n-hydroxysuccinimid,unii-mje3791m4t,ccris 2604 PubChem CID: 80170 IUPAC Name: 1-hydroxypyrrolidine-2,5-dione SMILES: C1CC(=O)N(C1=O)O

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PubChem CID	80170
CAS	6066-82-6
Molecular Weight (g/mol)	115.09
MDL Number	MFCD00005516
SMILES	C1CC(=O)N(C1=O)O
Synonym	n-hydroxysuccinimide,hosu,1-hydroxysuccinimide,2,5-pyrrolidinedione, 1-hydroxy,1-hydroxy-2,5-pyrrolidinedione,succinimide, n-hydroxy,n-hydroxysuccinimde,n-hydroxysuccinimid,unii-mje3791m4t,ccris 2604
IUPAC Name	1-hydroxypyrrolidine-2,5-dione
InChI Key	NQTADLQHYWFPDB-UHFFFAOYSA-N
Molecular Formula	C₄H₅NO₃

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(+/-)-1-Boc-3-aminopyrrolidine, 96%

CAS: 186550-13-0 Molecular Formula: C9H19N2O2 Molecular Weight (g/mol): 187.26 MDL Number: MFCD01861220 InChI Key: CMIBWIAICVBURI-SSDOTTSWSA-O Synonym: 1-boc-3-aminopyrrolidine,3-amino-1-boc-pyrrolidine,+/--3-amino-1-n-boc-pyrrolidine,3-amino-1-n-boc-pyrrolidine,3-amino-1-tert-butoxycarbonyl pyrrolidine,+/--1-boc-3-aminopyrrolidine,3-amino-pyrrolidine-1-carboxylic acid tert-butyl ester,1-pyrrolidinecarboxylic acid, 3-amino-, 1,1-dimethylethyl ester,n-boc-3-aminopyrrolidine,1-bocap PubChem CID: 2756370 IUPAC Name: tert-butyl 3-aminopyrrolidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CC[C@@H]([NH3+])C1

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PubChem CID	2756370
CAS	186550-13-0
Molecular Weight (g/mol)	187.26
MDL Number	MFCD01861220
SMILES	CC(C)(C)OC(=O)N1CC[C@@H]([NH3+])C1
Synonym	1-boc-3-aminopyrrolidine,3-amino-1-boc-pyrrolidine,+/--3-amino-1-n-boc-pyrrolidine,3-amino-1-n-boc-pyrrolidine,3-amino-1-tert-butoxycarbonyl pyrrolidine,+/--1-boc-3-aminopyrrolidine,3-amino-pyrrolidine-1-carboxylic acid tert-butyl ester,1-pyrrolidinecarboxylic acid, 3-amino-, 1,1-dimethylethyl ester,n-boc-3-aminopyrrolidine,1-bocap
IUPAC Name	tert-butyl 3-aminopyrrolidine-1-carboxylate
InChI Key	CMIBWIAICVBURI-SSDOTTSWSA-O
Molecular Formula	C9H19N2O2

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N-Carbamoylmaleimide, tech. 90%

CAS: 3345-50-4 Molecular Formula: C5H4N2O3 Molecular Weight (g/mol): 140.098 MDL Number: MFCD00014539 InChI Key: BNPFHEFZJPVCCE-UHFFFAOYSA-N Synonym: n-carbamoylmaleimide,n-carbamylmaleimide,2,5-dioxo-3-pyrroline-1-carboxamide,2,5-dioxo-2,5-dihydro-1h-pyrrole-1-carboxamide,n-carbamoylmaleiimide,3-pyrrolinecarboxamide, 2,5-dioxo,3-pyrroline-2,5-dione, 1-carbamoyl,1h-pyrrole-1-carboxamide, 2,5-dihydro-2,5-dioxo-9ci,2,5-dihydro-2,5-dioxo-1h-pyrrole-1-carboxamide,2,5-dioxoazolinecarboxamide PubChem CID: 76868 IUPAC Name: 2,5-dioxopyrrole-1-carboxamide SMILES: C1=CC(=O)N(C1=O)C(=O)N

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PubChem CID	76868
CAS	3345-50-4
Molecular Weight (g/mol)	140.098
MDL Number	MFCD00014539
SMILES	C1=CC(=O)N(C1=O)C(=O)N
Synonym	n-carbamoylmaleimide,n-carbamylmaleimide,2,5-dioxo-3-pyrroline-1-carboxamide,2,5-dioxo-2,5-dihydro-1h-pyrrole-1-carboxamide,n-carbamoylmaleiimide,3-pyrrolinecarboxamide, 2,5-dioxo,3-pyrroline-2,5-dione, 1-carbamoyl,1h-pyrrole-1-carboxamide, 2,5-dihydro-2,5-dioxo-9ci,2,5-dihydro-2,5-dioxo-1h-pyrrole-1-carboxamide,2,5-dioxoazolinecarboxamide
IUPAC Name	2,5-dioxopyrrole-1-carboxamide
InChI Key	BNPFHEFZJPVCCE-UHFFFAOYSA-N
Molecular Formula	C5H4N2O3

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Disuccinimidyl suberate, 97%

CAS: 68528-80-3 Molecular Formula: C16H20N2O8 Molecular Weight (g/mol): 368.342 MDL Number: MFCD00049059 InChI Key: ZWIBGKZDAWNIFC-UHFFFAOYSA-N Synonym: disuccinimidyl suberate,bis 2,5-dioxopyrrolidin-1-yl octanedioate,suberic acid bis n-hydroxysuccinimide ester,di n-succinimidyl suberate,bicl100,2,5-pyrrolidinedione, 1,1'-1,8-dioxo-1,8-octanediyl bis oxy bis,nhs-sa,disuccinimidylsuberate,dsis,n-hydroxysuccinimide suberic acid ester PubChem CID: 100658 IUPAC Name: bis(2,5-dioxopyrrolidin-1-yl) octanedioate SMILES: C1CC(=O)N(C1=O)OC(=O)CCCCCCC(=O)ON2C(=O)CCC2=O

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Specifications

PubChem CID	100658
CAS	68528-80-3
Molecular Weight (g/mol)	368.342
MDL Number	MFCD00049059
SMILES	C1CC(=O)N(C1=O)OC(=O)CCCCCCC(=O)ON2C(=O)CCC2=O
Synonym	disuccinimidyl suberate,bis 2,5-dioxopyrrolidin-1-yl octanedioate,suberic acid bis n-hydroxysuccinimide ester,di n-succinimidyl suberate,bicl100,2,5-pyrrolidinedione, 1,1'-1,8-dioxo-1,8-octanediyl bis oxy bis,nhs-sa,disuccinimidylsuberate,dsis,n-hydroxysuccinimide suberic acid ester
IUPAC Name	bis(2,5-dioxopyrrolidin-1-yl) octanedioate
InChI Key	ZWIBGKZDAWNIFC-UHFFFAOYSA-N
Molecular Formula	C16H20N2O8

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N-Boc-L-beta-proline, 95%, Thermo Scientific Chemicals

CAS: 140148-70-5 Molecular Formula: C10H17NO4 Molecular Weight (g/mol): 215.249 MDL Number: MFCD03094728 InChI Key: HRMRQBJUFWFQLX-ZETCQYMHSA-N Synonym: s-1-boc-pyrrolidine-3-carboxylic acid,s-1-n-boc-beta-proline,s-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,n-boc-l-beta-proline,3s-1-tert-butoxycarbonyl-3-pyrrolidinecarboxylic acid,s-n-boc-pyrrolidine-3-carboxylic acid,3s-boc-beta-pro-oh,3s-1-boc-pyrrolidine-3-carboxylic acid,boc-3s-1-pyrrolidine-3-carboxylic acid PubChem CID: 1512492 IUPAC Name: (3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCC(C1)C(=O)O

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Specifications

PubChem CID	1512492
CAS	140148-70-5
Molecular Weight (g/mol)	215.249
MDL Number	MFCD03094728
SMILES	CC(C)(C)OC(=O)N1CCC(C1)C(=O)O
Synonym	s-1-boc-pyrrolidine-3-carboxylic acid,s-1-n-boc-beta-proline,s-1-tert-butoxycarbonyl pyrrolidine-3-carboxylic acid,n-boc-l-beta-proline,3s-1-tert-butoxycarbonyl-3-pyrrolidinecarboxylic acid,s-n-boc-pyrrolidine-3-carboxylic acid,3s-boc-beta-pro-oh,3s-1-boc-pyrrolidine-3-carboxylic acid,boc-3s-1-pyrrolidine-3-carboxylic acid
IUPAC Name	(3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
InChI Key	HRMRQBJUFWFQLX-ZETCQYMHSA-N
Molecular Formula	C10H17NO4

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N-Vinyl-2-pyrrolidone, 99%, stabilized with NaOH

CAS: 88-12-0 Molecular Formula: C₆H₉NO Molecular Weight (g/mol): 111.14 MDL Number: MFCD00003197 InChI Key: WHNWPMSKXPGLAX-UHFFFAOYSA-N Synonym: n-vinyl-2-pyrrolidone,n-vinylpyrrolidone,1-vinyl-2-pyrrolidone,1-vinylpyrrolidin-2-one,n-vinyl-2-pyrrolidinone,vinylpyrrolidone,2-pyrrolidinone, 1-ethenyl,1-vinyl-2-pyrrolidinone,n-vinylpyrrolidinone,1-vinylpyrrolidone PubChem CID: 6917 ChEBI: CHEBI:82551 IUPAC Name: 1-ethenylpyrrolidin-2-one SMILES: C=CN1CCCC1=O

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Specifications

PubChem CID	6917
CAS	88-12-0
Molecular Weight (g/mol)	111.14
ChEBI	CHEBI:82551
MDL Number	MFCD00003197
SMILES	C=CN1CCCC1=O
Synonym	n-vinyl-2-pyrrolidone,n-vinylpyrrolidone,1-vinyl-2-pyrrolidone,1-vinylpyrrolidin-2-one,n-vinyl-2-pyrrolidinone,vinylpyrrolidone,2-pyrrolidinone, 1-ethenyl,1-vinyl-2-pyrrolidinone,n-vinylpyrrolidinone,1-vinylpyrrolidone
IUPAC Name	1-ethenylpyrrolidin-2-one
InChI Key	WHNWPMSKXPGLAX-UHFFFAOYSA-N
Molecular Formula	C₆H₉NO

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3-Hydroxy-2-pyrrolidinone, 95%, Thermo Scientific Chemicals

CAS: 15166-68-4 Molecular Formula: C4H7NO2 Molecular Weight (g/mol): 101.105 MDL Number: MFCD09751256 InChI Key: FRKGSNOMLIYPSH-UHFFFAOYSA-N Synonym: 3-hydroxy-2-pyrrolidinone,2-pyrrolidinone, 3-hydroxy,3-hydroxy-pyrrolidin-2-one,a-hydroxy-?-butyrolactam,acmc-209pe0,3-oxidanylpyrrolidin-2-one,3-hydroxy-2-oxopyrrolidine,3-hydroxypyrrolidine-2-one PubChem CID: 10240772 IUPAC Name: 3-hydroxypyrrolidin-2-one SMILES: C1CNC(=O)C1O

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Specifications

PubChem CID	10240772
CAS	15166-68-4
Molecular Weight (g/mol)	101.105
MDL Number	MFCD09751256
SMILES	C1CNC(=O)C1O
Synonym	3-hydroxy-2-pyrrolidinone,2-pyrrolidinone, 3-hydroxy,3-hydroxy-pyrrolidin-2-one,a-hydroxy-?-butyrolactam,acmc-209pe0,3-oxidanylpyrrolidin-2-one,3-hydroxy-2-oxopyrrolidine,3-hydroxypyrrolidine-2-one
IUPAC Name	3-hydroxypyrrolidin-2-one
InChI Key	FRKGSNOMLIYPSH-UHFFFAOYSA-N
Molecular Formula	C4H7NO2

Angiotensin I (human)

CAS: 484-42-4 Molecular Formula: C62H89N17O14 Molecular Weight (g/mol): 1296.50 MDL Number: MFCD00133091 InChI Key: ORWYRWWVDCYOMK-HBZPZAIKSA-N Synonym: angiotensin i,human angiotensin i,angiotensin i human,5-ile-angiotensin i,angiotensin i rat,angiotensin i mouse,angiotensin 1 human,angiotensin i human, mouse, rat,pepsitensin,ile5-angiotensin i PubChem CID: 3081372 ChEBI: CHEBI:2718 IUPAC Name: (2S)-2-[(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-5-[(diaminomethylidene)amino]pentanamido]-3-methylbutanamido]-3-(4-hydroxyphenyl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-phenylpropanamido]-3-(1H-imidazol-5-yl)propanamido]-4-methylpentanoic acid SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CC(C)C)C(O)=O

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Specifications

PubChem CID	3081372
CAS	484-42-4
Molecular Weight (g/mol)	1296.50
ChEBI	CHEBI:2718
MDL Number	MFCD00133091
SMILES	CC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@@H](CC(C)C)C(O)=O
Synonym	angiotensin i,human angiotensin i,angiotensin i human,5-ile-angiotensin i,angiotensin i rat,angiotensin i mouse,angiotensin 1 human,angiotensin i human, mouse, rat,pepsitensin,ile5-angiotensin i
IUPAC Name	(2S)-2-[(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-5-[(diaminomethylidene)amino]pentanamido]-3-methylbutanamido]-3-(4-hydroxyphenyl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-phenylpropanamido]-3-(1H-imidazol-5-yl)propanamido]-4-methylpentanoic acid
InChI Key	ORWYRWWVDCYOMK-HBZPZAIKSA-N
Molecular Formula	C62H89N17O14

Pyrrolidines

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