Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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Kerosene (Odorless), Fisher Chemical™

CAS: 64742-47-8 MDL Number: MFCD00135561

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CAS	64742-47-8
MDL Number	MFCD00135561

Pepstatin A, Fisher BioReagents

CAS: 26305-03-3 Molecular Formula: C34H63N5O9 Molecular Weight (g/mol): 685.904 InChI Key: FAXGPCHRFPCXOO-WQILDUGRSA-N Synonym: pepstatin a PubChem CID: 131801262 IUPAC Name: (3R,4S)-3-hydroxy-4-[[(2R)-2-[[(3R,4S)-3-hydroxy-6-methyl-4-[[(2S)-3-methyl-2-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]butanoyl]amino]heptanoyl]amino]propanoyl]amino]-6-methylheptanoic acid SMILES: CC(C)CC(C(CC(=O)O)O)NC(=O)C(C)NC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)O

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Specifications

PubChem CID	131801262
CAS	26305-03-3
Molecular Weight (g/mol)	685.904
SMILES	CC(C)CC(C(CC(=O)O)O)NC(=O)C(C)NC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)O
Synonym	pepstatin a
IUPAC Name	(3R,4S)-3-hydroxy-4-[[(2R)-2-[[(3R,4S)-3-hydroxy-6-methyl-4-[[(2S)-3-methyl-2-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]butanoyl]amino]heptanoyl]amino]propanoyl]amino]-6-methylheptanoic acid
InChI Key	FAXGPCHRFPCXOO-WQILDUGRSA-N
Molecular Formula	C34H63N5O9

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Guanidine Thiocyanate (White Crystalline Powder), Fisher BioReagents™

CAS: 593-84-0 Molecular Formula: C₂H₆N₄S Synonym: Guanidinium Isothiocyanate

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Specifications

CAS	593-84-0
Synonym	Guanidinium Isothiocyanate
Molecular Formula	C₂H₆N₄S

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D-Galactose (White to Off-white Powder), Fisher BioReagents

CAS: 59-23-4 Molecular Formula: C₆H₁₂O₆

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Specifications

CAS	59-23-4
Molecular Formula	C₆H₁₂O₆

Thermo Scientific Chemicals Clofazimine, 98%

CAS: 2030-63-9 Molecular Formula: C₂₇H₂₂Cl₂N₄ Molecular Weight (g/mol): 473.4 InChI Key: WDQPAMHFFCXSNU-UHFFFAOYSA-N PubChem CID: 2794 ChEBI: CHEBI:3749

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Specifications

PubChem CID	2794
CAS	2030-63-9
Molecular Weight (g/mol)	473.4
ChEBI	CHEBI:3749
InChI Key	WDQPAMHFFCXSNU-UHFFFAOYSA-N
Molecular Formula	C₂₇H₂₂Cl₂N₄

MilliporeSigma™ BCECF/AM Calbiochem™,

CAS: 117464-70-7 Molecular Formula: C42H40O21 Molecular Weight (g/mol): 880.76 MDL Number: MFCD00036969 InChI Key: NTECHUXHORNEGZ-UHFFFAOYSA-N Synonym: bcecf-acetoxymethyl,bcecf-am solution,2',7'-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester,acetyloxy methyl 3-3',6'-bis acetyloxy methoxy-2'-3-acetyloxy methoxy-3-oxopropyl-5-acetyloxy methoxy carbonyl-3-oxospiro 2-benzofuran-1,9'-xanthen-7'-yl propanoate,bcecf-am solution 5 mm in dmso , 1 mg in 0.25 ml dmso,spiro isobenzofuran-1 3h ,9'-9h xanthene-2',7'-dipropanoic acid,2',7'-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester mixed isomers,2',7'-bis 2-carboxyethyl-5 6-carboxyfluorescein tetrakis-acetoxymethyl ester,2 inverted exclamation marka,7 inverted exclamation marka-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester,2 inverted exclamation marka,7 inverted exclamation marka-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester mixed isomers PubChem CID: 53229972 IUPAC Name: (acetyloxy)methyl 3-{3',6'-bis[(acetyloxy)methoxy]-7'-{3-[(acetyloxy)methoxy]-3-oxopropyl}-5-{[(acetyloxy)methoxy]carbonyl}-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-2'-yl}propanoate SMILES: CC(=O)OCOC(=O)CCC1=C(OCOC(C)=O)C=C2OC3=CC(OCOC(C)=O)=C(CCC(=O)OCOC(C)=O)C=C3C3(OC(=O)C4=C3C=CC(=C4)C(=O)OCOC(C)=O)C2=C1

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Specifications

PubChem CID	53229972
CAS	117464-70-7
Molecular Weight (g/mol)	880.76
MDL Number	MFCD00036969
SMILES	CC(=O)OCOC(=O)CCC1=C(OCOC(C)=O)C=C2OC3=CC(OCOC(C)=O)=C(CCC(=O)OCOC(C)=O)C=C3C3(OC(=O)C4=C3C=CC(=C4)C(=O)OCOC(C)=O)C2=C1
Synonym	bcecf-acetoxymethyl,bcecf-am solution,2',7'-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester,acetyloxy methyl 3-3',6'-bis acetyloxy methoxy-2'-3-acetyloxy methoxy-3-oxopropyl-5-acetyloxy methoxy carbonyl-3-oxospiro 2-benzofuran-1,9'-xanthen-7'-yl propanoate,bcecf-am solution 5 mm in dmso , 1 mg in 0.25 ml dmso,spiro isobenzofuran-1 3h ,9'-9h xanthene-2',7'-dipropanoic acid,2',7'-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester mixed isomers,2',7'-bis 2-carboxyethyl-5 6-carboxyfluorescein tetrakis-acetoxymethyl ester,2 inverted exclamation marka,7 inverted exclamation marka-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester,2 inverted exclamation marka,7 inverted exclamation marka-bis 2-carboxyethyl-5 6-carboxyfluorescein acetoxymethyl ester mixed isomers
IUPAC Name	(acetyloxy)methyl 3-{3',6'-bis[(acetyloxy)methoxy]-7'-{3-[(acetyloxy)methoxy]-3-oxopropyl}-5-{[(acetyloxy)methoxy]carbonyl}-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-2'-yl}propanoate
InChI Key	NTECHUXHORNEGZ-UHFFFAOYSA-N
Molecular Formula	C42H40O21

TraceCERT™ Organophosphorous Pesticide Mix A, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

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Thermo Scientific Chemicals 2'-Deoxythymidine-5'-diphosphate trisodium salt, 97%

CAS: 95648-78-5 Molecular Formula: C10H13N2Na3O11P2 Molecular Weight (g/mol): 468.13 MDL Number: MFCD00084748 InChI Key: HBYPEEZBYHQLDM-SPSULGLQSA-K PubChem CID: 133109123 IUPAC Name: trisodium;[[(2S,3R,5S)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl] phosphate SMILES: [Na+].[Na+].[Na+].CC1=CN([C@H]2C[C@H](O)[C@@H](COP([O-])(=O)OP([O-])([O-])=O)O2)C(=O)NC1=O

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Specifications

PubChem CID	133109123
CAS	95648-78-5
Molecular Weight (g/mol)	468.13
MDL Number	MFCD00084748
SMILES	[Na+].[Na+].[Na+].CC1=CN([C@H]2C[C@H](O)[C@@H](COP([O-])(=O)OP([O-])([O-])=O)O2)C(=O)NC1=O
IUPAC Name	trisodium;[[(2S,3R,5S)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-oxidophosphoryl] phosphate
InChI Key	HBYPEEZBYHQLDM-SPSULGLQSA-K
Molecular Formula	C10H13N2Na3O11P2

L(+)-2-Aminobutyric acid, 98%

CAS: 1492-24-6 Molecular Formula: C₄H₉NO₂ Molecular Weight (g/mol): 103.12 MDL Number: MFCD00064415 InChI Key: QWCKQJZIFLGMSD-VKHMYHEASA-N Synonym: l-2-aminobutyric acid,s-2-aminobutanoic acid,2s-2-aminobutanoic acid,h-abu-oh,l-alpha-aminobutyric acid,s-+-2-aminobutyric acid,l-+-2-aminobutyric acid,--2-aminobutyric acid,s-2-aminobutyric acid,s-2-amino-butyric acid PubChem CID: 80283 ChEBI: CHEBI:35619 IUPAC Name: (2S)-2-aminobutanoic acid SMILES: CCC(C(=O)O)N

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Specifications

PubChem CID	80283
CAS	1492-24-6
Molecular Weight (g/mol)	103.12
ChEBI	CHEBI:35619
MDL Number	MFCD00064415
SMILES	CCC(C(=O)O)N
Synonym	l-2-aminobutyric acid,s-2-aminobutanoic acid,2s-2-aminobutanoic acid,h-abu-oh,l-alpha-aminobutyric acid,s-+-2-aminobutyric acid,l-+-2-aminobutyric acid,--2-aminobutyric acid,s-2-aminobutyric acid,s-2-amino-butyric acid
IUPAC Name	(2S)-2-aminobutanoic acid
InChI Key	QWCKQJZIFLGMSD-VKHMYHEASA-N
Molecular Formula	C₄H₉NO₂

Magnesium acrylate

CAS: 5698-98-6 Molecular Formula: C6H6MgO4 Molecular Weight (g/mol): 166.415 MDL Number: MFCD00068285 InChI Key: DWLAVVBOGOXHNH-UHFFFAOYSA-L Synonym: magnesium acrylate,unii-38v94j49hw,2-propenoic acid, magnesium salt 2:1,2-propenoic acid, magnesium salt,79-10-7 parent,magnesium di-acrylate,magnesium acrylate 5g,acmc-1alvh,magnesium prop-2-enoate,diacrylic acid magnesium salt PubChem CID: 165336 IUPAC Name: magnesium;prop-2-enoate SMILES: C=CC(=O)[O-].C=CC(=O)[O-].[Mg+2]

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Specifications

PubChem CID	165336
CAS	5698-98-6
Molecular Weight (g/mol)	166.415
MDL Number	MFCD00068285
SMILES	C=CC(=O)[O-].C=CC(=O)[O-].[Mg+2]
Synonym	magnesium acrylate,unii-38v94j49hw,2-propenoic acid, magnesium salt 2:1,2-propenoic acid, magnesium salt,79-10-7 parent,magnesium di-acrylate,magnesium acrylate 5g,acmc-1alvh,magnesium prop-2-enoate,diacrylic acid magnesium salt
IUPAC Name	magnesium;prop-2-enoate
InChI Key	DWLAVVBOGOXHNH-UHFFFAOYSA-L
Molecular Formula	C6H6MgO4

Thermo Scientific Chemicals Maltotriose, 98%

CAS: 1109-28-0 Molecular Formula: C18H32O16 Molecular Weight (g/mol): 504.438 MDL Number: MFCD00006629 InChI Key: FYGDTMLNYKFZSV-NBCPLHMPSA-N Synonym: maltotriose,d-maltotriose PubChem CID: 134129496 IUPAC Name: (2R,3S,4S,5S,6R)-2-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4S,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol SMILES: C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)O)O

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Specifications

PubChem CID	134129496
CAS	1109-28-0
Molecular Weight (g/mol)	504.438
MDL Number	MFCD00006629
SMILES	C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)O)O
Synonym	maltotriose,d-maltotriose
IUPAC Name	(2R,3S,4S,5S,6R)-2-[(2R,3R,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4S,5R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChI Key	FYGDTMLNYKFZSV-NBCPLHMPSA-N
Molecular Formula	C18H32O16

CHAPS, 98%, Thermo Scientific Chemicals

CAS: 75621-03-3 Molecular Formula: C₃₂H₅₈N₂O₇S Molecular Weight (g/mol): 614.9 MDL Number: MFCD00012116 InChI Key: UMCMPZBLKLEWAF-GBSSQDIOSA-N Synonym: 3-[(3-Cholamidopropyl)dimethylammonio]-1-propanesulfonate PubChem CID: 134129639 IUPAC Name: 3-[dimethyl-[3-[[(4R)-4-[(3R,5S,7R,8R,9R,10S,12S,13R,14R,17S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]propyl]azaniumyl]propane-1-sulfonate SMILES: CC(CCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C

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Specifications

PubChem CID	134129639
CAS	75621-03-3
Molecular Weight (g/mol)	614.9
MDL Number	MFCD00012116
SMILES	CC(CCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
Synonym	3-[(3-Cholamidopropyl)dimethylammonio]-1-propanesulfonate
IUPAC Name	3-[dimethyl-[3-[[(4R)-4-[(3R,5S,7R,8R,9R,10S,12S,13R,14R,17S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]propyl]azaniumyl]propane-1-sulfonate
InChI Key	UMCMPZBLKLEWAF-GBSSQDIOSA-N
Molecular Formula	C₃₂H₅₈N₂O₇S

N-Boc-L-isoleucine, 98+%

CAS: 13139-16-7 Molecular Formula: C11H21NO4 Molecular Weight (g/mol): 231.29 MDL Number: MFCD00038324 MFCD00237550 InChI Key: QJCNLJWUIOIMMF-YUMQZZPRSA-N Synonym: boc-l-isoleucine,boc-ile-oh,n-boc-l-isoleucine,n-tert-butoxycarbonyl-l-isoleucine,boc-dl-ile-oh,boc-l-ile-oh,2s,3s-2-tert-butoxycarbonyl amino-3-methylpentanoic acid,l-isoleucine, n-1,1-dimethylethoxy carbonyl,boc-isoleucine,n-t-boc-l-isoleucine PubChem CID: 2724762 IUPAC Name: (2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid SMILES: CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(O)=O

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Specifications

PubChem CID	2724762
CAS	13139-16-7
Molecular Weight (g/mol)	231.29
MDL Number	MFCD00038324 MFCD00237550
SMILES	CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(O)=O
Synonym	boc-l-isoleucine,boc-ile-oh,n-boc-l-isoleucine,n-tert-butoxycarbonyl-l-isoleucine,boc-dl-ile-oh,boc-l-ile-oh,2s,3s-2-tert-butoxycarbonyl amino-3-methylpentanoic acid,l-isoleucine, n-1,1-dimethylethoxy carbonyl,boc-isoleucine,n-t-boc-l-isoleucine
IUPAC Name	(2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
InChI Key	QJCNLJWUIOIMMF-YUMQZZPRSA-N
Molecular Formula	C11H21NO4

D-Epoxone, 98%

CAS: 18422-53-2 Molecular Formula: C12H18O6 Molecular Weight (g/mol): 258.27 MDL Number: MFCD00063383 InChI Key: IVWWFWFVSWOTLP-RDNCKJRISA-N Synonym: 3ar,4'r,7ar-2,2,2',2'-tetramethyldihydrospiro 1,3 dioxolo 4,5-c pyran-6,4'-1,3 dioxolan-7 7ah-one PubChem CID: 118990039 IUPAC Name: (4S,7'aR)-2,2,2',2'-tetramethylspiro[1,3-dioxolane-4,6'-4,7a-dihydro-3aH-[1,3]dioxolo[4,5-c]pyran]-7'-one SMILES: CC1(OCC2(O1)C(=O)C3C(CO2)OC(O3)(C)C)C

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Specifications

PubChem CID	118990039
CAS	18422-53-2
Molecular Weight (g/mol)	258.27
MDL Number	MFCD00063383
SMILES	CC1(OCC2(O1)C(=O)C3C(CO2)OC(O3)(C)C)C
Synonym	3ar,4'r,7ar-2,2,2',2'-tetramethyldihydrospiro 1,3 dioxolo 4,5-c pyran-6,4'-1,3 dioxolan-7 7ah-one
IUPAC Name	(4S,7'aR)-2,2,2',2'-tetramethylspiro[1,3-dioxolane-4,6'-4,7a-dihydro-3aH-[1,3]dioxolo[4,5-c]pyran]-7'-one
InChI Key	IVWWFWFVSWOTLP-RDNCKJRISA-N
Molecular Formula	C12H18O6

Betaine monohydrate, 99+%, for analysis

CAS: 590-47-6 Molecular Formula: C5H13NO3 Molecular Weight (g/mol): 135.16 MDL Number: MFCD00150010 InChI Key: NJZRLXNBGZBREL-UHFFFAOYSA-N Synonym: betaine monohydrate,2-trimethylammonio acetate hydrate,glycine betaine hydrate,unii-tpu0itr2br,carboxymethyl trimethylammonium hydroxide,tpu0itr2br,bet hydrate,betaine, hydrate,dsstox_cid_29381,dsstox_rid_83496 PubChem CID: 134128033 IUPAC Name: carboxymethyl(trimethyl)azanium;hydroxide;hydrate SMILES: [OH-].C[N+](C)(C)CC(O)=O

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Specifications

PubChem CID	134128033
CAS	590-47-6
Molecular Weight (g/mol)	135.16
MDL Number	MFCD00150010
SMILES	[OH-].C[N+](C)(C)CC(O)=O
Synonym	betaine monohydrate,2-trimethylammonio acetate hydrate,glycine betaine hydrate,unii-tpu0itr2br,carboxymethyl trimethylammonium hydroxide,tpu0itr2br,bet hydrate,betaine, hydrate,dsstox_cid_29381,dsstox_rid_83496
IUPAC Name	carboxymethyl(trimethyl)azanium;hydroxide;hydrate
InChI Key	NJZRLXNBGZBREL-UHFFFAOYSA-N
Molecular Formula	C5H13NO3

Unclassified Organic Compounds

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