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CAS Number: 3420-02-8
6-methyl-1H-indole

Structure

6-methyl-1H-indole
Name: 6-methyl-1H-indole
Synonyms:
General Information
Product Number: 3420028

CAS Registry Number 3420-02-8
Name:
1H-​Indole, 6-​methyl-
Indole, 6-methyl- (7CI,8CI)
6-Methyl-1H-indole
6-Methylindole

 

Chemical Formula: C9H9N
Exact Mass: 131.07
Molecular Weight: 131.17
m/z: 131.07 (100.0%), 132.08 (9.8%)

 

InChI:InChI=1S/C9H9N/c1-7-2-3-8-4-5-10-9(8)6-7/h2-6,10H,1H3

InChI Key:ONYNOPPOVKYGRS-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=C(C=C1)C=CN2

 

Thermal Properties Value Condition Note
Boiling Point 112-113 °C Press: 4-5 Torr (1)CAS
Boiling Point 75-78 °C Press: 1 Torr (2)CAS
Boiling Point See full text   (3)IC
Boiling Point See full text   (4)IC
Melting Point 159-161 °C   (9)CAS
Melting Point 26-27 °C   (10)CAS

Specification

98%

References
  1. (1) Taydakov, I. V.; Chemistry of Heterocyclic Compounds (New York, NY, United States) 2011, V47(4), P425-434 CAPLUS
  2. (2) Marion, Leo; Canadian Journal of Research, Section B: Chemical Sciences 1947, V25B, P1-13 CAPLUS
  3. (3) Sakamoto, Takao; Chemical & Pharmaceutical Bulletin 1987, V35(5), P1823-8 CAPLUS
  4. (4) Ito, Yoshihiko; Bulletin of the Chemical Society of Japan 1984, V57(1), P73-84 CAPLUS
  5. (9) Yanofsky, Charles; Science (Washington, DC, United States) 1955, V121, P138-9 CAPLUS
  6. (10) Andrisano, Renato; Gazzetta Chimica Italiana 1957, V87, P949-70 CAPLUS
  7. (11) Sus, Oskar; Justus Liebigs Annalen der Chemie 1955, V593, P91-126 CAPLUS
  8. (12) Raucher, Stanley; Journal of Organic Chemistry 1983, V48(12), P2066-9 CAPLUS
  9. (13) Muratake, Hideaki; Heterocycles 1989, V29(4), P771-82 CAPLUS
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