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Substance Name: 2,3-Dimethylindole
RN: 91-55-4
UNII: TFW7O9HWZK
InChIKey: PYFVEIDRTLBMHG-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C10-H11-N

Molecular Weight

  • 145.2039
 
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Names and Synonyms

Name of Substance

  • 2,3-Dimethylindole

Synonyms

  • 2,3-Dimethyl-1H-indole
  • 2,3-Dimethylindole
  • EINECS 202-076-2
  • NSC 24936
  • UNII-TFW7O9HWZK

Systematic Names

  • 1H-Indole, 2,3-dimethyl-
  • 2,3-Dimethyl-1H-indole
  • Indole, 2,3-dimethyl-

Registry Numbers

CAS Registry Number

  • 91-55-4

FDA UNII

  • TFW7O9HWZK

System Generated Number

  • 0000091554

Structure Descriptors

InChI

1S/C10H11N/c1-7-8(2)11-10-6-4-3-5-9(7)10/h3-6,11H,1-2H3

InChIKey

PYFVEIDRTLBMHG-UHFFFAOYSA-N

Smiles

Cc1c([nH]c2c1cccc2)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 106 deg C   EXP
Boiling Point 285 deg C   EXP
log P (octanol-water) 3.05 (none)   EXP
Water Solubility 198 mg/L 25 EST
Vapor Pressure 1.79E-03 mm Hg 25 EST
Henry's Law Constant 1.08E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.00E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.