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1530793-63-5

1530793-63-5 Structure

1530793-63-5 Structure
IdentificationBack Directory
[Name]

Benzo[b]thiophene-4-carboxylic acid, 2-amino-3-cyano-4,5,6,7-tetrahydro-4-methyl-
[CAS]

1530793-63-5
[Synonyms]

2-Amino-3-cyano-4-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-4-carboxylic acid
2-Amino-3-cyano-4,5,6,7-tetrahydro-4-methylbenzo[b]thiophene-4-carboxylic acid
Benzo[b]thiophene-4-carboxylic acid, 2-amino-3-cyano-4,5,6,7-tetrahydro-4-methyl-
[Molecular Formula]

C11H12N2O2S
[MOL File]

1530793-63-5.mol
[Molecular Weight]

236.29
Chemical PropertiesBack Directory
[Boiling point ]

505.1±50.0 °C(Predicted)
[density ]

1.41±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C, protect from light
[pka]

3.91±0.20(Predicted)
[Appearance]

Light yellow to brown Solid
[InChI]

InChI=1S/C11H12N2O2S/c1-11(10(14)15)4-2-3-7-8(11)6(5-12)9(13)16-7/h2-4,13H2,1H3,(H,14,15)
[InChIKey]

IITRDERXWQUMAG-UHFFFAOYSA-N
[SMILES]

C12CCCC(C)(C(O)=O)C=1C(C#N)=C(N)S2
Spectrum DetailBack Directory
[Spectrum Detail]

Benzo[b]thiophene-4-carboxylic acid, 2-amino-3-cyano-4,5,6,7-tetrahydro-4-methyl-(1530793-63-5)1HNMR
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