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I2006

Indole-3-carboxylic acid

Name: Indole-3-carboxylic acid
Brand: SIGMA

Synonym(s):

β-Indolylcarboxylic acid, 3-Carboxyindole, 3-Indole formic acid, 3-Indolylcarboxylic acid, Indole-β-carboxylic acid

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About This Item

Empirical Formula (Hill Notation):

C₉H₇NO₂

CAS Number:

771-50-6

Molecular Weight:

161.16

EC Number:

212-231-6

UNSPSC Code:

12352100

MDL number:

MFCD00005624

Beilstein/REAXYS Number:

129435

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Properties

mp

232-234 °C (dec.) (lit.)

SMILES string

OC(=O)c1c[nH]c2ccccc12

InChI

1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)

InChI key

KMAKOBLIOCQGJP-UHFFFAOYSA-N

Description

Application

Reactant for preparation of:

Anticancer agents
Derivatives of amino acids and peptides
Serotonin 5-HT4 receptor antagonists
Primary acylureas
Inhibitors of Gli1-mediated transcription in the Hedgehog pathway
Serotonin 5-HT6 antagonists
Very Late Antigen-4 (VLA-4) sntagonists
EphB3 receptor tyrosine kinase inhibitors
Potential Therapeutic Agent for Alzheimer′s Disease
Vinyl ester pseudotripeptide proteasome inhibitors

Regulatory Information

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