465313

1-Methylindole-3-carboxylic acid

97%

• Empirical Formula (Hill Notation): C₁₀H₉NO₂
• CAS Number: 32387-21-6
• Molecular Weight: 175.18
• UNSPSC Code: 12352100
• PubChem Substance ID: 24870267
• MDL number: MFCD01321244
• Assay: 97%

Properties

• Quality Segment: 100
• assay: 97%
• mp: 197-200 °C (dec.) (lit.)
• functional group: carboxylic acid
• SMILES string: Cn1cc(C(O)=O)c2ccccc12
• InChI: 1S/C10H9NO2/c1-11-6-8(10(12)13)7-4-2-3-5-9(7)11/h2-6H,1H3,(H,12,13)
• InChI key: HVRCLXXJIQTXHC-UHFFFAOYSA-N

Description

General description

1-Methylindole-3-carboxylic acid is an indole derivative that can be prepared by the oxidation of 1-methylindole-3-aldehyde with alkaline potassium permanganate.

Application

• Reactant for preparation of bisindolyl pyrimidinones analogs of PKC inhibitor LY333531
• Reactant for preparation of (heteroaryl)(carboxamido)arylpyrrole derivatives as Cdc7 kinase inhibitors, antitumor and antiproliferative agents
• Reactant for preparation of (pyrrolidinylmethoxy)cyclohexanecarboxylic acids as antigen-4 (VLA-4) antagonists
• Reactant for preparation of EphB3 receptor tyrosine kinase inhibitors
• Reactant for preparation of pyrazolodiazepine derivatives as human P2X7 receptor antagonists
• Reactant for preparation of potent nonpeptidic urotensin II receptor agonists
• Reactant for preparation of pyrrolizidine esters, amides, and ureas as 5-HT4 receptor ligands

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: dust mask type N95 (US), Eyeshields, Gloves