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CAS Number: 37842-85-6
1-(2-methyl-1H-indol-1-yl)ethanone

Structure

 1-(2-methyl-1H-indol-1-yl)ethanone
Name: 1-(2-methyl-1H-indol-1-yl)ethanone
Synonyms:
General Information
Product Number: 37842856

CAS Registry Number 37842-85-6
Name:
Ethanone, 1-?(2-?methyl-?1H-?indol-?1-?yl)?-
1H-Indole, 1-acetyl-2-methyl- (9CI)
1-Acetyl-2-methyl-1H-indole
1-Acetyl-2-methylindole
N-Acetyl-2-methylindole

 

Chemical Formula: C11H11NO
Exact Mass: 173.08
Molecular Weight: 173.21
m/z: 173.08 (100.0%), 174.09 (12.1%)

 

InChI:InChI=1S/C11H11NO/c1-8-7-10-5-3-4-6-11(10)12(8)9(2)13/h3-7H,1-2H3

InChI Key:MQKDFUDWMKTCNQ-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=CC=CC=C2N1C(=O)C

 

Thermal Properties Value Condition Note
Boiling Point 163-164 °C Press: 15 Torr (1)IC
Melting Point 42-43 °C Solv: ethanol (64-17-5) (4)IC
Melting Point 41-42 °C   (5)IC
Melting Point 39.5-41.5 °C   (6)IC

Specification

98%
References
  1. (1) Takechi, Haruko; Chemical & Pharmaceutical Bulletin 1988, V36(10), P3770-9 CAPLUS
  2. (4) Gribble, Gordon W.; Organic Preparations and Procedures International 1977, V9(6), P271-6 CAPLUS
  3. (5) Le Corre, M.; Tetrahedron 1985, V41(22), P5313-20 CAPLUS
  4. (6) Hegedus, Louis S.; Journal of the American Chemical Society 1978, V100(18), P5800-7 CAPLUS
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