Unclassified Organic Compounds

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

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1,876 – 1,890 of 207,671 results

1,876

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N,N-Dimethyl-L-phenylalanine, 99%

CAS: 17469-89-5 Molecular Formula: C11H15NO2 Molecular Weight (g/mol): 193.25 MDL Number: MFCD00082539 InChI Key: HOGIQTACRLIOHC-JTQLQIEISA-N Synonym: n,n-dimethyl-l-phenylalanine,phenylalanine, n,n-dimethyl,n,n-dimethylphenylalanine,l-phenylalanine, n,n-dimethyl,s-2-dimethylamino-3-phenylpropanoic acid,2s-2-dimethylamino-3-phenylpropanoic acid,alanine, n,n-dimethyl-3-phenyl-, l,l-phenylalanine,n,n-dimethyl,s-2-dimethylamino-3-phenyl-propionic acid PubChem CID: 11830289 IUPAC Name: (2S)-2-(dimethylamino)-3-phenylpropanoic acid SMILES: CN(C)[C@@H](CC1=CC=CC=C1)C(O)=O

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PubChem CID	11830289
CAS	17469-89-5
Molecular Weight (g/mol)	193.25
MDL Number	MFCD00082539
SMILES	CN(C)[C@@H](CC1=CC=CC=C1)C(O)=O
Synonym	n,n-dimethyl-l-phenylalanine,phenylalanine, n,n-dimethyl,n,n-dimethylphenylalanine,l-phenylalanine, n,n-dimethyl,s-2-dimethylamino-3-phenylpropanoic acid,2s-2-dimethylamino-3-phenylpropanoic acid,alanine, n,n-dimethyl-3-phenyl-, l,l-phenylalanine,n,n-dimethyl,s-2-dimethylamino-3-phenyl-propionic acid
IUPAC Name	(2S)-2-(dimethylamino)-3-phenylpropanoic acid
InChI Key	HOGIQTACRLIOHC-JTQLQIEISA-N
Molecular Formula	C11H15NO2

1,877

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Ethyl acetamidocyanoacetate, 98%, Thermo Scientific Chemicals

CAS: 4977-62-2 Molecular Formula: C7H10N2O3 Molecular Weight (g/mol): 170.17 MDL Number: MFCD00009133 InChI Key: SLIRLABNGAZSHX-UHFFFAOYNA-N Synonym: ethyl acetamidocyanoacetate,ethyl acetaminocyanoacetate,n-acetyl-2-cyanoglycine ethyl ester,ethyl 2-cyano-2-acetamidoacetate,acetic acid, acetylamino cyano-, ethyl ester,ethyl 2-acetylamino-2-cyanoacetate,ethyl acetamido cyano acetate,glycine, n-acetyl-2-cyano-, ethyl ester,acmc-209ki4,ethyl acetamido-cyanoacetate PubChem CID: 95422 IUPAC Name: ethyl 2-acetamido-2-cyanoacetate SMILES: CCOC(=O)C(NC(C)=O)C#N

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Specifications

PubChem CID	95422
CAS	4977-62-2
Molecular Weight (g/mol)	170.17
MDL Number	MFCD00009133
SMILES	CCOC(=O)C(NC(C)=O)C#N
Synonym	ethyl acetamidocyanoacetate,ethyl acetaminocyanoacetate,n-acetyl-2-cyanoglycine ethyl ester,ethyl 2-cyano-2-acetamidoacetate,acetic acid, acetylamino cyano-, ethyl ester,ethyl 2-acetylamino-2-cyanoacetate,ethyl acetamido cyano acetate,glycine, n-acetyl-2-cyano-, ethyl ester,acmc-209ki4,ethyl acetamido-cyanoacetate
IUPAC Name	ethyl 2-acetamido-2-cyanoacetate
InChI Key	SLIRLABNGAZSHX-UHFFFAOYNA-N
Molecular Formula	C7H10N2O3

1,878

Glassy carbon spherical powder, 400-630 micron, type 2

MDL Number: MFCD00133992

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Specifications

MDL Number	MFCD00133992

1,879

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2,6-Dimethyl-4-pyrone, 99%

CAS: 1004-36-0 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00006579 InChI Key: VSYFZULSKMFUJJ-UHFFFAOYSA-N Synonym: 2,6-dimethyl-4h-pyran-4-one,2,6-dimethyl-4-pyrone,2,6-dimethyl-gamma-pyrone,2,6-dimethyl-4-pyranone,4h-pyran-4-one, 2,6-dimethyl,gamma-2,6-dimethylpyrone,unii-v2d262mf0l,2,6-dimethyl-pyran-4-one,2,6-dimethyl-.gamma.-pyrone,ccris 3601 PubChem CID: 13862 IUPAC Name: 2,6-dimethylpyran-4-one SMILES: CC1=CC(=O)C=C(O1)C

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Specifications

PubChem CID	13862
CAS	1004-36-0
Molecular Weight (g/mol)	124.139
MDL Number	MFCD00006579
SMILES	CC1=CC(=O)C=C(O1)C
Synonym	2,6-dimethyl-4h-pyran-4-one,2,6-dimethyl-4-pyrone,2,6-dimethyl-gamma-pyrone,2,6-dimethyl-4-pyranone,4h-pyran-4-one, 2,6-dimethyl,gamma-2,6-dimethylpyrone,unii-v2d262mf0l,2,6-dimethyl-pyran-4-one,2,6-dimethyl-.gamma.-pyrone,ccris 3601
IUPAC Name	2,6-dimethylpyran-4-one
InChI Key	VSYFZULSKMFUJJ-UHFFFAOYSA-N
Molecular Formula	C7H8O2

1,880

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L-Buthionine-(S,R)-sulfoximine, 99%

CAS: 83730-53-4 Molecular Formula: C₈H₁₈N₂O₃S Molecular Weight (g/mol): 222.31 MDL Number: MFCD00067000 InChI Key: KJQFBVYMGADDTQ-CVSPRKDYSA-N Synonym: l-buthionine-sulfoximine,l-buthionine sulfoximine,2s-2-amino-4-butylsulfonimidoyl butanoic acid,l-buthionine-s,r-sulfoximine,l-buthionine s,r-sulfoximine,l-bso,butanoic acid, 2-amino-4-s-butylsulfonimidoyl-, 2s,l-buthionine sr-sulfoximine,buthionine-s,r-sulfoximine, l,l-buthionine-s,r-sulphoximine PubChem CID: 119565 IUPAC Name: (2S)-2-amino-4-(butylsulfonimidoyl)butanoic acid SMILES: CCCCS(=N)(=O)CCC(C(=O)O)N

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Specifications

PubChem CID	119565
CAS	83730-53-4
Molecular Weight (g/mol)	222.31
MDL Number	MFCD00067000
SMILES	CCCCS(=N)(=O)CCC(C(=O)O)N
Synonym	l-buthionine-sulfoximine,l-buthionine sulfoximine,2s-2-amino-4-butylsulfonimidoyl butanoic acid,l-buthionine-s,r-sulfoximine,l-buthionine s,r-sulfoximine,l-bso,butanoic acid, 2-amino-4-s-butylsulfonimidoyl-, 2s,l-buthionine sr-sulfoximine,buthionine-s,r-sulfoximine, l,l-buthionine-s,r-sulphoximine
IUPAC Name	(2S)-2-amino-4-(butylsulfonimidoyl)butanoic acid
InChI Key	KJQFBVYMGADDTQ-CVSPRKDYSA-N
Molecular Formula	C₈H₁₈N₂O₃S

1,881

10H-Phenothiazine-10-propanesulfonic acid sodium salt, Thermo Scientific Chemicals

CAS: 101199-38-6 Molecular Formula: C15H14NNaO3S2 Molecular Weight (g/mol): 343.39 InChI Key: VKGYKXFNSKEHED-UHFFFAOYSA-M IUPAC Name: sodium 3-(10H-phenothiazin-10-yl)propane-1-sulfonate SMILES: [Na+].[O-]S(=O)(=O)CCCN1C2=CC=CC=C2SC2=CC=CC=C12

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Specifications

CAS	101199-38-6
Molecular Weight (g/mol)	343.39
SMILES	[Na+].[O-]S(=O)(=O)CCCN1C2=CC=CC=C2SC2=CC=CC=C12
IUPAC Name	sodium 3-(10H-phenothiazin-10-yl)propane-1-sulfonate
InChI Key	VKGYKXFNSKEHED-UHFFFAOYSA-M
Molecular Formula	C15H14NNaO3S2

1,882

Caerulein sulfated, >95%, MP Biomedicals™

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1,883

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N-(4-Chloro-2-butynyl)phthalimide, 97%

CAS: 4819-69-6 Molecular Formula: C12H8ClNO2 Molecular Weight (g/mol): 233.651 MDL Number: MFCD01318120 InChI Key: TXNDRPKNOXQAAO-UHFFFAOYSA-N Synonym: n-4-chloro-2-butynyl phthalimide,2-4-chlorobut-2-yn-1-yl isoindoline-1,3-dione,2-4-chlorobut-2-yn-1-yl-1h-isoindole-1,3 2h-dione,2-4-chlorobut-2-yn-1-yl isoindole-1,3-dione,acmc-20akbi,n-4-chlorobut-2-ynyl phthalimide,2-4-chlorobut-2-ynyl isoindole-1,3-dione,2-4-chloro-2-butynyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-chloro-2-butyn-1-yl,2-4-chlorobut-2-yn-1-yl-2,3-dihydro-1h-isoindole-1,3-dione PubChem CID: 237537 IUPAC Name: 2-(4-chlorobut-2-ynyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CC#CCCl

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Specifications

PubChem CID	237537
CAS	4819-69-6
Molecular Weight (g/mol)	233.651
MDL Number	MFCD01318120
SMILES	C1=CC=C2C(=C1)C(=O)N(C2=O)CC#CCCl
Synonym	n-4-chloro-2-butynyl phthalimide,2-4-chlorobut-2-yn-1-yl isoindoline-1,3-dione,2-4-chlorobut-2-yn-1-yl-1h-isoindole-1,3 2h-dione,2-4-chlorobut-2-yn-1-yl isoindole-1,3-dione,acmc-20akbi,n-4-chlorobut-2-ynyl phthalimide,2-4-chlorobut-2-ynyl isoindole-1,3-dione,2-4-chloro-2-butynyl isoindoline-1,3-dione,1h-isoindole-1,3 2h-dione, 2-4-chloro-2-butyn-1-yl,2-4-chlorobut-2-yn-1-yl-2,3-dihydro-1h-isoindole-1,3-dione
IUPAC Name	2-(4-chlorobut-2-ynyl)isoindole-1,3-dione
InChI Key	TXNDRPKNOXQAAO-UHFFFAOYSA-N
Molecular Formula	C12H8ClNO2

1,884

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cis-2-Hydroxymethyl-1-cyclohexylamine hydrochloride, 99%

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1,885

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Thermo Scientific Chemicals N-Oxalylglycine

CAS: 5262-39-5 Molecular Formula: C4H5NO5 Molecular Weight (g/mol): 147.09 InChI Key: BIMZLRFONYSTPT-UHFFFAOYSA-N IUPAC Name: 2-(carboxyformamido)acetic acid SMILES: OC(=O)CNC(=O)C(O)=O

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Specifications

CAS	5262-39-5
Molecular Weight (g/mol)	147.09
SMILES	OC(=O)CNC(=O)C(O)=O
IUPAC Name	2-(carboxyformamido)acetic acid
InChI Key	BIMZLRFONYSTPT-UHFFFAOYSA-N
Molecular Formula	C4H5NO5

1,886

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Hexaketocyclohexane octahydrate, 99%

CAS: 7255-28-9 Molecular Formula: C6O6 Molecular Weight (g/mol): 168.06 MDL Number: MFCD00001652,MFCD00149074 InChI Key: PKRGYJHUXHCUCN-UHFFFAOYSA-N Synonym: cyclohexanehexone,triquinoyl,cyclohexane-1,2,3,4,5,6-hexaone,cyclohexanehexaone,hexaketocyclohexane,unii-7zr8062lfd,trichinoyl,hexaoxocyclohexane,hexaoxocyclohexaneoctahydrate,cyclohexane-hexone, octahydrate PubChem CID: 68240 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexone SMILES: O=C1C(=O)C(=O)C(=O)C(=O)C1=O

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Specifications

PubChem CID	68240
CAS	7255-28-9
Molecular Weight (g/mol)	168.06
MDL Number	MFCD00001652,MFCD00149074
SMILES	O=C1C(=O)C(=O)C(=O)C(=O)C1=O
Synonym	cyclohexanehexone,triquinoyl,cyclohexane-1,2,3,4,5,6-hexaone,cyclohexanehexaone,hexaketocyclohexane,unii-7zr8062lfd,trichinoyl,hexaoxocyclohexane,hexaoxocyclohexaneoctahydrate,cyclohexane-hexone, octahydrate
IUPAC Name	cyclohexane-1,2,3,4,5,6-hexone
InChI Key	PKRGYJHUXHCUCN-UHFFFAOYSA-N
Molecular Formula	C6O6

1,887

Cefixime trihydrate, ≥98.0% (HPLC), MilliporeSigma™ Supelco™

MDL Number: MFCD03788802

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Specifications

MDL Number	MFCD03788802

1,888

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Betaine hydrochloride, 99%, extra pure, specified according to the requirements of USP

CAS: 590-46-5 Molecular Formula: C5H12ClNO2 Molecular Weight (g/mol): 153.61 MDL Number: MFCD00011903 InChI Key: HOPSCVCBEOCPJZ-UHFFFAOYSA-N Synonym: betaine hydrochloride,betaine chloride,pluchine,acidogeno,acipepsol,achylin,acidin,acinorm,acidol,acidine PubChem CID: 11545 IUPAC Name: carboxymethyl(trimethyl)azanium;chloride SMILES: [Cl-].C[N+](C)(C)CC(O)=O

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PubChem CID	11545
CAS	590-46-5
Molecular Weight (g/mol)	153.61
MDL Number	MFCD00011903
SMILES	[Cl-].C[N+](C)(C)CC(O)=O
Synonym	betaine hydrochloride,betaine chloride,pluchine,acidogeno,acipepsol,achylin,acidin,acinorm,acidol,acidine
IUPAC Name	carboxymethyl(trimethyl)azanium;chloride
InChI Key	HOPSCVCBEOCPJZ-UHFFFAOYSA-N
Molecular Formula	C5H12ClNO2

1,889

Thermo Scientific Chemicals D-(+)-Cellotetraose, 95%

CAS: 38819-01-1 Molecular Formula: C24H42O21 Molecular Weight (g/mol): 666.579 MDL Number: MFCD00079079 InChI Key: LUEWUZLMQUOBSB-HQXNUCTASA-N Synonym: cellotetraose PubChem CID: 131674892 IUPAC Name: (2S,3S,5S)-2-[(3S,5S,6S)-6-[(3S,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(3S,5S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-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)OC4C(OC(C(C4O)O)O)CO)CO)CO)O)O)O)O

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Specifications

PubChem CID	131674892
CAS	38819-01-1
Molecular Weight (g/mol)	666.579
MDL Number	MFCD00079079
SMILES	C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)O)CO)CO)CO)O)O)O)O
Synonym	cellotetraose
IUPAC Name	(2S,3S,5S)-2-[(3S,5S,6S)-6-[(3S,5S,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(3S,5S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
InChI Key	LUEWUZLMQUOBSB-HQXNUCTASA-N
Molecular Formula	C24H42O21

1,890

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Diethylbenzene, mixture of isomers

CAS: 25340-17-4 Molecular Formula: C₁₀H₁₄ MDL Number: MFCD00792900 Synonym: Dowex J

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Specifications

CAS	25340-17-4
MDL Number	MFCD00792900
Synonym	Dowex J
Molecular Formula	C₁₀H₁₄

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