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Indole-3-carboxylic acid, 98%, Thermo Scientific Chemicals

Catalog No. AAA1263414
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Indole-3-carboxylic acid is used as a raw material in synthesis. The structures of the derivatives of indole-3-carboxylic acid were studied using gas chromatography with high resolution mass spectrometry (GC-HRMS), ultra-high performance liquid chromatography in combination with high resolution tandem mass spectrometry (UHPLC-HRMS), nuclear magnetic resonance spectroscopy (NMR) and Fourier transform infrared spectroscopy. 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

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
Indole-3-carboxylic acid is used as a raw material in synthesis. The structures of the derivatives of indole-3-carboxylic acid were studied using gas chromatography with high resolution mass spectrometry (GC-HRMS), ultra-high performance liquid chromatography in combination with high resolution tandem mass spectrometry (UHPLC-HRMS), nuclear magnetic resonance spectroscopy (NMR) and Fourier transform infrared spectroscopy. 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

Solubility
Soluble in 95% Ethanol: 50 mg/ml, also soluble in methanol.

Notes
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Keep away from strong oxidizing agents. Stable under ordinary conditions.

Chemical Identifiers

CAS

771-50-6

Molecular Formula

C9H7NO2

Molecular Weight (g/mol)

161.16

MDL Number

MFCD00005624

InChI Key

KMAKOBLIOCQGJP-UHFFFAOYSA-N

Synonym

indole-3-carboxylic acid, 3-indoleformic acid, 3-carboxyindole, indole-3-carboxylicacid, 3-indolecarboxylic acid, indole-3-carboxylate, 3-indolylcarboxylic acid, beta-indolylcarboxylic acid, indole-3 carboxylic acid, ico

PubChem CID

69867

ChEBI

CHEBI:24809

IUPAC Name

1H-indole-3-carboxylic acid

SMILES

C1=CC=C2C(=C1)C(=CN2)C(=O)O

Specifications

Melting Point

∼239°C (decomposition)

Quantity

25 g

Beilstein

129435

Solubility Information

Soluble in 95% Ethanol: 50mg/ml,also soluble in methanol.

Formula Weight

161.16

Percent Purity

98%

Chemical Name or Material

Indole-3-carboxylic acid

Hazard Category

H302+H312-H315-H319-H335

Hazard Statement

GHS H Statement
H315-H319-H335
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.

Precautionary Statement

P261-P264b-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P362-P501c

EINECSNumber

212-231-6

RTECSNumber

NK7882892

TSCA

No

Recommended Storage

Ambient temperatures

RUO – Research Use Only

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