Piperidines

Organic heterocyclic compounds that consist of a six-membered ring containing five carbon atoms and one nitrogen atom that forms an amine functional group.

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4-Amino-2,2,6,6-tetramethylpiperidine, 98%

CAS: 36768-62-4 Molecular Formula: C9H22N2 Molecular Weight (g/mol): 158.29 MDL Number: MFCD00005984 InChI Key: FTVFPPFZRRKJIH-UHFFFAOYSA-P Synonym: 4-amino-2,2,6,6-tetramethylpiperidine,triacetonediamine,2,2,6,6-tetramethyl-4-aminopiperidine,4-piperidinamine, 2,2,6,6-tetramethyl,unii-etf220q65r,2,2,6,6-tetramethyl-4-piperidylamine,4-amino-2,2,6,6-tetramethyl-piperidine,piperidine, 4-amino-2,2,6,6-tetramethyl,2,2,6,6-tetramethyl-4-piperidinamine,4-amino-2,2,6,6-tetramethyl piperidine PubChem CID: 37524 SMILES: CC1(C)CC([NH3+])CC(C)(C)[NH2+]1

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PubChem CID	37524
CAS	36768-62-4
Molecular Weight (g/mol)	158.29
MDL Number	MFCD00005984
SMILES	CC1(C)CC([NH3+])CC(C)(C)[NH2+]1
Synonym	4-amino-2,2,6,6-tetramethylpiperidine,triacetonediamine,2,2,6,6-tetramethyl-4-aminopiperidine,4-piperidinamine, 2,2,6,6-tetramethyl,unii-etf220q65r,2,2,6,6-tetramethyl-4-piperidylamine,4-amino-2,2,6,6-tetramethyl-piperidine,piperidine, 4-amino-2,2,6,6-tetramethyl,2,2,6,6-tetramethyl-4-piperidinamine,4-amino-2,2,6,6-tetramethyl piperidine
InChI Key	FTVFPPFZRRKJIH-UHFFFAOYSA-P
Molecular Formula	C9H22N2

1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxylic acid, Thermo Scientific™

CAS: 950603-35-7 Molecular Formula: C9H10F3N3O2S Molecular Weight (g/mol): 281.25 MDL Number: MFCD11101440 InChI Key: PWQMNLMMMCREOV-UHFFFAOYSA-N Synonym: 1-5-trifluoromethyl-1,3,4-thiadiazol-2-yl piperidine-4-carboxylic acid PubChem CID: 33589561 IUPAC Name: 1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxylic acid SMILES: OC(=O)C1CCN(CC1)C1=NN=C(S1)C(F)(F)F

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Specifications

PubChem CID	33589561
CAS	950603-35-7
Molecular Weight (g/mol)	281.25
MDL Number	MFCD11101440
SMILES	OC(=O)C1CCN(CC1)C1=NN=C(S1)C(F)(F)F
Synonym	1-5-trifluoromethyl-1,3,4-thiadiazol-2-yl piperidine-4-carboxylic acid
IUPAC Name	1-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperidine-4-carboxylic acid
InChI Key	PWQMNLMMMCREOV-UHFFFAOYSA-N
Molecular Formula	C9H10F3N3O2S

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Ethyl (R)-nipecotate L-tartrate, 98%, Thermo Scientific Chemicals

CAS: 167392-57-6 Molecular Formula: C12H21NO8 Molecular Weight (g/mol): 307.299 MDL Number: MFCD00799538 InChI Key: HHPGQKZOPPDLNH-RATVZYDNSA-N Synonym: s,s-tartaric acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-bis oxidanyl butanedioic acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-dihydroxybutanedioic acid; 3r-3-piperidinecarboxylic acid ethyl ester PubChem CID: 53249980 IUPAC Name: (3S)-2,3-dihydroxybutanedioic acid;ethyl (3R)-piperidine-3-carboxylate SMILES: CCOC(=O)C1CCCNC1.C(C(C(=O)O)O)(C(=O)O)O

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Specifications

PubChem CID	53249980
CAS	167392-57-6
Molecular Weight (g/mol)	307.299
MDL Number	MFCD00799538
SMILES	CCOC(=O)C1CCCNC1.C(C(C(=O)O)O)(C(=O)O)O
Synonym	s,s-tartaric acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-bis oxidanyl butanedioic acid; ethyl 3r-piperidine-3-carboxylate,3s-2,3-dihydroxybutanedioic acid; 3r-3-piperidinecarboxylic acid ethyl ester
IUPAC Name	(3S)-2,3-dihydroxybutanedioic acid;ethyl (3R)-piperidine-3-carboxylate
InChI Key	HHPGQKZOPPDLNH-RATVZYDNSA-N
Molecular Formula	C12H21NO8

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4-(2-Fluorobenzyl)piperidine hydrochloride, 97%

CAS: 193357-21-0 Molecular Formula: C12H17ClFN Molecular Weight (g/mol): 229.72 MDL Number: MFCD08669673 InChI Key: XZRQMBCQGGXDKQ-UHFFFAOYSA-N Synonym: 4-3-fluorobenzyl piperidine hydrochloride,4-3-fluorophenyl methyl piperidine hydrochloride,4-3-fluoro-benzyl-piperidine hydrochloride,4-3-fluorobenzyl piperidine hcl PubChem CID: 17039493 SMILES: Cl.FC1=CC=CC(CC2CCNCC2)=C1

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Specifications

PubChem CID	17039493
CAS	193357-21-0
Molecular Weight (g/mol)	229.72
MDL Number	MFCD08669673
SMILES	Cl.FC1=CC=CC(CC2CCNCC2)=C1
Synonym	4-3-fluorobenzyl piperidine hydrochloride,4-3-fluorophenyl methyl piperidine hydrochloride,4-3-fluoro-benzyl-piperidine hydrochloride,4-3-fluorobenzyl piperidine hcl
InChI Key	XZRQMBCQGGXDKQ-UHFFFAOYSA-N
Molecular Formula	C12H17ClFN

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1-Boc-4-hydroxypiperidine, 98%, Thermo Scientific Chemicals

CAS: 109384-19-2 Molecular Formula: C10H19NO3 Molecular Weight (g/mol): 201.266 MDL Number: MFCD01075174 InChI Key: PWQLFIKTGRINFF-UHFFFAOYSA-N Synonym: n-boc-4-hydroxypiperidine,1-boc-4-hydroxypiperidine,n-boc-4-piperidinol,1-boc-4-piperidinol,n-boc-4-hydroxylpiperidine,n-boc-4-hydroxy piperidine,1-tert-butoxycarbonyl-4-hydroxypiperidine,4-hydroxy-n-boc-piperidine,1-boc-4-hydroxy-piperidine PubChem CID: 643502 IUPAC Name: tert-butyl 4-hydroxypiperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC(CC1)O

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Specifications

PubChem CID	643502
CAS	109384-19-2
Molecular Weight (g/mol)	201.266
MDL Number	MFCD01075174
SMILES	CC(C)(C)OC(=O)N1CCC(CC1)O
Synonym	n-boc-4-hydroxypiperidine,1-boc-4-hydroxypiperidine,n-boc-4-piperidinol,1-boc-4-piperidinol,n-boc-4-hydroxylpiperidine,n-boc-4-hydroxy piperidine,1-tert-butoxycarbonyl-4-hydroxypiperidine,4-hydroxy-n-boc-piperidine,1-boc-4-hydroxy-piperidine
IUPAC Name	tert-butyl 4-hydroxypiperidine-1-carboxylate
InChI Key	PWQLFIKTGRINFF-UHFFFAOYSA-N
Molecular Formula	C10H19NO3

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2-(1-Piperidinyl)benzonitrile, 97%

CAS: 72752-52-4 Molecular Formula: C12H14N2 Molecular Weight (g/mol): 186.258 MDL Number: MFCD00049221 InChI Key: MEBVSLLKZSAIGK-UHFFFAOYSA-N Synonym: 2-piperidinobenzonitrile,2-piperidin-1-yl benzonitrile,2-1-piperidinyl benzonitrile,gnf-pf-3161,benzonitrile, 2-1-piperidinyl,2-piperidylbenzenecarbonitrile,2-piperidino benzonitrile,maybridge1_000930,acmc-1bfz1,2-1-piperidyl benzonitrile PubChem CID: 2774355 IUPAC Name: 2-piperidin-1-ylbenzonitrile SMILES: C1CCN(CC1)C2=CC=CC=C2C#N

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Specifications

PubChem CID	2774355
CAS	72752-52-4
Molecular Weight (g/mol)	186.258
MDL Number	MFCD00049221
SMILES	C1CCN(CC1)C2=CC=CC=C2C#N
Synonym	2-piperidinobenzonitrile,2-piperidin-1-yl benzonitrile,2-1-piperidinyl benzonitrile,gnf-pf-3161,benzonitrile, 2-1-piperidinyl,2-piperidylbenzenecarbonitrile,2-piperidino benzonitrile,maybridge1_000930,acmc-1bfz1,2-1-piperidyl benzonitrile
IUPAC Name	2-piperidin-1-ylbenzonitrile
InChI Key	MEBVSLLKZSAIGK-UHFFFAOYSA-N
Molecular Formula	C12H14N2

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Isonipecotamide, 98%

CAS: 39546-32-2 Molecular Formula: C6H12N2O Molecular Weight (g/mol): 128.18 MDL Number: MFCD00038012 InChI Key: DPBWFNDFMCCGGJ-UHFFFAOYSA-N Synonym: isonipecotamide,4-piperidinecarboxamide,hexahydroisonicotinamide,4-carbamoylpiperidine,isonipectoamide,piperidine-4-carboxylic acid amide,4-piperdinecarboxamide,piperidin-4-carboxamid,iso nipecotamide,iso-nipecotamide PubChem CID: 3772 IUPAC Name: piperidine-4-carboxamide SMILES: NC(=O)C1CCNCC1

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Specifications

PubChem CID	3772
CAS	39546-32-2
Molecular Weight (g/mol)	128.18
MDL Number	MFCD00038012
SMILES	NC(=O)C1CCNCC1
Synonym	isonipecotamide,4-piperidinecarboxamide,hexahydroisonicotinamide,4-carbamoylpiperidine,isonipectoamide,piperidine-4-carboxylic acid amide,4-piperdinecarboxamide,piperidin-4-carboxamid,iso nipecotamide,iso-nipecotamide
IUPAC Name	piperidine-4-carboxamide
InChI Key	DPBWFNDFMCCGGJ-UHFFFAOYSA-N
Molecular Formula	C6H12N2O

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PubChem CID	3772
CAS	39546-32-2
Molecular Weight (g/mol)	128.18
MDL Number	MFCD00038012
SMILES	NC(=O)C1CCNCC1
Synonym	isonipecotamide,4-piperidinecarboxamide,hexahydroisonicotinamide,4-carbamoylpiperidine,isonipectoamide,piperidine-4-carboxylic acid amide,4-piperdinecarboxamide,piperidin-4-carboxamid,iso nipecotamide,iso-nipecotamide
IUPAC Name	piperidine-4-carboxamide
InChI Key	DPBWFNDFMCCGGJ-UHFFFAOYSA-N
Molecular Formula	C6H12N2O

3-Piperidinobenzoic acid, 97%, Thermo Scientific™

CAS: 77940-94-4 Molecular Formula: C12H15NO2 Molecular Weight (g/mol): 205.257 MDL Number: MFCD06659081 InChI Key: FLQRORYAJSTYLT-UHFFFAOYSA-N Synonym: 3-piperidinobenzoic acid,3-piperidin-1-yl benzoic acid,3-piperidin-1-yl-benzoic acid,1-3-carboxyphenyl piperidine,3-1-piperidinyl benzoic acid,3-piperidylbenzoic acid,benzoic acid,3-1-piperidinyl,benzoic acid, 3-1-piperidinyl PubChem CID: 2795552 IUPAC Name: 3-piperidin-1-ylbenzoic acid SMILES: C1CCN(CC1)C2=CC=CC(=C2)C(=O)O

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Specifications

PubChem CID	2795552
CAS	77940-94-4
Molecular Weight (g/mol)	205.257
MDL Number	MFCD06659081
SMILES	C1CCN(CC1)C2=CC=CC(=C2)C(=O)O
Synonym	3-piperidinobenzoic acid,3-piperidin-1-yl benzoic acid,3-piperidin-1-yl-benzoic acid,1-3-carboxyphenyl piperidine,3-1-piperidinyl benzoic acid,3-piperidylbenzoic acid,benzoic acid,3-1-piperidinyl,benzoic acid, 3-1-piperidinyl
IUPAC Name	3-piperidin-1-ylbenzoic acid
InChI Key	FLQRORYAJSTYLT-UHFFFAOYSA-N
Molecular Formula	C12H15NO2

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N-(Ethoxycarbonyl)nortropinone, 99%, Thermo Scientific™

CAS: 32499-64-2 Molecular Formula: C10H15NO3 Molecular Weight (g/mol): 197.234 MDL Number: MFCD00078171 InChI Key: ANEJUHJDPGTVIO-UHFFFAOYSA-N Synonym: ethyl 3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylate,n-ethoxycarbonyl nortropinone,n-carbethoxy-4-nortropinone,n-carbethoxy-4-tropinone,8-ethoxycarbonyl-8-azabicyclo 3.2.1 octan-3-one,3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylic acid ethyl ester,8-azabicyclo 3.2.1 octane-8-carboxylic acid, 3-oxo-, ethyl ester,8-ethoxycarbonyl-8-azabicyclo 3.2.1 octane-3-one,n-carbethoxynortropinone PubChem CID: 401882 IUPAC Name: ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate SMILES: CCOC(=O)N1C2CCC1CC(=O)C2

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Specifications

PubChem CID	401882
CAS	32499-64-2
Molecular Weight (g/mol)	197.234
MDL Number	MFCD00078171
SMILES	CCOC(=O)N1C2CCC1CC(=O)C2
Synonym	ethyl 3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylate,n-ethoxycarbonyl nortropinone,n-carbethoxy-4-nortropinone,n-carbethoxy-4-tropinone,8-ethoxycarbonyl-8-azabicyclo 3.2.1 octan-3-one,3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylic acid ethyl ester,8-azabicyclo 3.2.1 octane-8-carboxylic acid, 3-oxo-, ethyl ester,8-ethoxycarbonyl-8-azabicyclo 3.2.1 octane-3-one,n-carbethoxynortropinone
IUPAC Name	ethyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate
InChI Key	ANEJUHJDPGTVIO-UHFFFAOYSA-N
Molecular Formula	C10H15NO3

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4-Aminomethyl-1-Boc-piperidine, 97%

CAS: 144222-22-0 Molecular Formula: C11H23N2O2 Molecular Weight (g/mol): 215.32 MDL Number: MFCD01076207 InChI Key: KLKBCNDBOVRQIJ-UHFFFAOYSA-O Synonym: 1-boc-4-aminomethyl piperidine,tert-butyl 4-aminomethyl piperidine-1-carboxylate,1-boc-4-aminomethylpiperidine,1-boc-4-aminomethyl-piperidine,4-aminomethyl-1-n-boc-piperidine,boc-4-aminomethyl-piperidine,4-aminomethyl-1-n-t-butoxycarbonyl piperidine,4-aminomethyl-1-boc-piperidine,1-n-boc-4-aminomethyl piperidine,4-aminomethyl-piperidine-1-carboxylic acid tert-butyl ester PubChem CID: 736817 IUPAC Name: {1-[(tert-butoxy)carbonyl]piperidin-4-yl}methanaminium SMILES: CC(C)(C)OC(=O)N1CCC(C[NH3+])CC1

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Specifications

PubChem CID	736817
CAS	144222-22-0
Molecular Weight (g/mol)	215.32
MDL Number	MFCD01076207
SMILES	CC(C)(C)OC(=O)N1CCC(C[NH3+])CC1
Synonym	1-boc-4-aminomethyl piperidine,tert-butyl 4-aminomethyl piperidine-1-carboxylate,1-boc-4-aminomethylpiperidine,1-boc-4-aminomethyl-piperidine,4-aminomethyl-1-n-boc-piperidine,boc-4-aminomethyl-piperidine,4-aminomethyl-1-n-t-butoxycarbonyl piperidine,4-aminomethyl-1-boc-piperidine,1-n-boc-4-aminomethyl piperidine,4-aminomethyl-piperidine-1-carboxylic acid tert-butyl ester
IUPAC Name	{1-[(tert-butoxy)carbonyl]piperidin-4-yl}methanaminium
InChI Key	KLKBCNDBOVRQIJ-UHFFFAOYSA-O
Molecular Formula	C11H23N2O2

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4-Amino-1-benzylpiperidine, 98%

CAS: 50541-93-0 Molecular Formula: C₁₂H₁₈N₂ Molecular Weight (g/mol): 190.29 MDL Number: MFCD00006504 InChI Key: YUBDLZGUSSWQSS-UHFFFAOYSA-N Synonym: 4-amino-1-benzylpiperidine,1-benzyl-4-aminopiperidine,1-benzyl-piperidin-4-ylamine,n-benzyl-4-amino piperidine,1-benzyl-4-piperidylamine,4-piperidinamine, 1-phenylmethyl,4-amino-1-n-benzylpiperidine,4-amino-n-benzylpiperidine,1-phenylmethyl-4-piperidinamine,n-benzyl-4-aminopiperidine PubChem CID: 415852 IUPAC Name: 1-benzylpiperidin-4-amine SMILES: C1CN(CCC1N)CC2=CC=CC=C2

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Specifications

PubChem CID	415852
CAS	50541-93-0
Molecular Weight (g/mol)	190.29
MDL Number	MFCD00006504
SMILES	C1CN(CCC1N)CC2=CC=CC=C2
Synonym	4-amino-1-benzylpiperidine,1-benzyl-4-aminopiperidine,1-benzyl-piperidin-4-ylamine,n-benzyl-4-amino piperidine,1-benzyl-4-piperidylamine,4-piperidinamine, 1-phenylmethyl,4-amino-1-n-benzylpiperidine,4-amino-n-benzylpiperidine,1-phenylmethyl-4-piperidinamine,n-benzyl-4-aminopiperidine
IUPAC Name	1-benzylpiperidin-4-amine
InChI Key	YUBDLZGUSSWQSS-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₈N₂

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delta-Valerolactam, 99%

CAS: 675-20-7 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 MDL Number: MFCD00006037 InChI Key: XUWHAWMETYGRKB-UHFFFAOYSA-N Synonym: 2-piperidone,2-piperidinone,delta-valerolactam,valerolactim,5-pentanolactam,piperidinone,piperidon,piperidone,alpha-piperidone,piperidone-2 PubChem CID: 12665 ChEBI: CHEBI:77761 IUPAC Name: piperidin-2-one SMILES: O=C1CCCCN1

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Specifications

PubChem CID	12665
CAS	675-20-7
Molecular Weight (g/mol)	99.13
ChEBI	CHEBI:77761
MDL Number	MFCD00006037
SMILES	O=C1CCCCN1
Synonym	2-piperidone,2-piperidinone,delta-valerolactam,valerolactim,5-pentanolactam,piperidinone,piperidon,piperidone,alpha-piperidone,piperidone-2
IUPAC Name	piperidin-2-one
InChI Key	XUWHAWMETYGRKB-UHFFFAOYSA-N
Molecular Formula	C5H9NO

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N-Boc-DL-pipecolinic acid, 98%

CAS: 98303-20-9 Molecular Formula: C11H19NO4 Molecular Weight (g/mol): 229.276 MDL Number: MFCD01862877 InChI Key: JQAOHGMPAAWWQO-UHFFFAOYSA-N Synonym: n-boc-2-piperidinecarboxylic acid,1-tert-butoxycarbonyl piperidine-2-carboxylic acid,1-boc-piperidine-2-carboxylic acid,n-boc-dl-pipecolinic acid,n-boc-piperidine-2-carboxylic acid,boc-dl-pip-oh,n-boc-pipecolic acid,1-n-boc-2-piperidinecarboxylic acid,1-tert-butoxy carbonyl piperidine-2-carboxylic acid,1-tert-butoxycarbonyl-2-piperidinecarboxylic acid PubChem CID: 581831 IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCCCC1C(=O)O

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Specifications

PubChem CID	581831
CAS	98303-20-9
Molecular Weight (g/mol)	229.276
MDL Number	MFCD01862877
SMILES	CC(C)(C)OC(=O)N1CCCCC1C(=O)O
Synonym	n-boc-2-piperidinecarboxylic acid,1-tert-butoxycarbonyl piperidine-2-carboxylic acid,1-boc-piperidine-2-carboxylic acid,n-boc-dl-pipecolinic acid,n-boc-piperidine-2-carboxylic acid,boc-dl-pip-oh,n-boc-pipecolic acid,1-n-boc-2-piperidinecarboxylic acid,1-tert-butoxy carbonyl piperidine-2-carboxylic acid,1-tert-butoxycarbonyl-2-piperidinecarboxylic acid
IUPAC Name	1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
InChI Key	JQAOHGMPAAWWQO-UHFFFAOYSA-N
Molecular Formula	C11H19NO4

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1-Boc-isonipecotic acid, 98+%

CAS: 84358-13-4 Molecular Formula: C11H19NO4 Molecular Weight (g/mol): 229.28 MDL Number: MFCD00076999 InChI Key: JWOHBPPVVDQMKB-UHFFFAOYSA-N Synonym: n-boc-isonipecotic acid,1-tert-butoxycarbonyl piperidine-4-carboxylic acid,n-boc-piperidine-4-carboxylic acid,1-boc-piperidine-4-carboxylic acid,boc-inp-oh,1-boc-isonipecotic acid,1-tert-butoxycarbonyl-4-piperidinecarboxylic acid,boc-isonipecotic acid,1-boc-4-piperidinecarboxylic acid,1-tert-butoxy carbonyl piperidine-4-carboxylic acid PubChem CID: 392871 IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C(O)=O

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Specifications

PubChem CID	392871
CAS	84358-13-4
Molecular Weight (g/mol)	229.28
MDL Number	MFCD00076999
SMILES	CC(C)(C)OC(=O)N1CCC(CC1)C(O)=O
Synonym	n-boc-isonipecotic acid,1-tert-butoxycarbonyl piperidine-4-carboxylic acid,n-boc-piperidine-4-carboxylic acid,1-boc-piperidine-4-carboxylic acid,boc-inp-oh,1-boc-isonipecotic acid,1-tert-butoxycarbonyl-4-piperidinecarboxylic acid,boc-isonipecotic acid,1-boc-4-piperidinecarboxylic acid,1-tert-butoxy carbonyl piperidine-4-carboxylic acid
IUPAC Name	1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
InChI Key	JWOHBPPVVDQMKB-UHFFFAOYSA-N
Molecular Formula	C11H19NO4

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