41069

2-Methylindole

analytical standard

• Synonym(s): NSC 7514
• Empirical Formula (Hill Notation): C₉H₉N
• CAS Number: 95-20-5
• Molecular Weight: 131.17
• Beilstein/REAXYS Number: 109781
• EC Number: 202-398-3
• MDL number: MFCD00005616
• UNSPSC Code: 12352200
• PubChem Substance ID: 329756052
• NACRES: NA.24

Properties

• grade: analytical standard
• Quality Level: 100
• assay: ≥98.0% (HPLC)
• shelf life: limited shelf life, expiry date on the label
• bp: 273 °C (lit.)
• mp: 57-59 °C (lit.)
• application(s): cleaning products; cosmetics; flavors and fragrances; food and beverages; personal care
• format: neat
• SMILES string: Cc1cc2ccccc2[nH]1
• InChI: 1S/C9H9N/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6,10H,1H3
• InChI key: BHNHHSOHWZKFOX-UHFFFAOYSA-N

Description

Application

Reactant for:

• Regioselective synthesis of oxopyrrolidine analogs via iodine-catalyzed Markovnikov addition reaction
• Friedel-Crafts alkylation reactions
• Preparation of tryptophan dioxygenase inhibitors pyridyl-ethenyl-indoles as potential anticancer immunomodulators
• Preparation of plant-growth inhibitors
• Michael addition reactions
• Synthesis of cyclooxygenase-1 (COX-1)/cyclooxygenase-2 (COX-2) inhibitors

Recommended products

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Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302
• pcodes: P264 - P270 - P301 + P312 - P501
• Hazard Classifications: Acute Tox. 4 Oral
• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: 285.8 °F
• flash_point_c: 141 °C