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CAS Number: 1075-34-9
5-bromo-2-methyl-1H-indole

Structure

5-bromo-2-methyl-1H-indole
Name: 5-bromo-2-methyl-1H-indole
Synonyms:
General Information
Product Number: 1075349

CAS Registry Number 1075-34-9
Name:
1H-?Indole, 5-?bromo-?2-?methyl-
Indole, 5-bromo-2-methyl- (6CI,7CI,8CI)
2-Methyl-1H-indol-5-yl bromide
2-Methyl-5-bromoindole
5-Bromo-2-methyl-1H-indole
5-Bromo-2-methylindole

 

Chemical Formula: C9H8BrN
Exact Mass: 208.98
Molecular Weight: 210.07
m/z: 208.98 (100.0%), 210.98 (97.3%), 209.99 (9.8%), 211.99 (9.6%)

 

InChI:InChI=1S/C9H8BrN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-5,11H,1H3

InChI Key:BJUZAZKEDCDGRW-UHFFFAOYSA-N

Canonical SMILES:CC1=CC2=C(N1)C=CC(=C2)Br

 

Thermal Properties Value Condition Note
Boiling Point 155-162 °C Press: 4 Torr (1)CAS
Boiling Point 147-148 °C Press: 4 Torr (2)CAS
Melting Point 104-105 °C   (3)CAS
Melting Point 97-98 °C   (1)CAS
Melting Point 93-96 °C   (4)CAS

Specification

98%

References
  1. (1) Terent'ev, A. P.; Zhurnal Obshchei Khimii 1959, V29, P2541-51 CAPLUS
  2. (2) Terent'ev, A. P.; Zhurnal Obshchei Khimii 1959, V29, P317-23 CAPLUS
  3. (3) Thesing, Jan; Justus Liebigs Annalen der Chemie 1964, V680, P52-9 CAPLUS
  4. (4) Colo, V.; Farmaco, Edizione Scientifica 1954, V9, P611-16 CAPLUS
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