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CAS Number: 7135-31-1
2-chloro-1H-indole

Structure

 2-chloro-1H-indole
Name: 2-chloro-1H-indole
Synonyms:
General Information
Product Number: 7135311

CAS Registry Number 7135-31-1
Name:
1H-?Indole, 2-?chloro-
Indole, 2-chloro- (7CI,8CI)
2-Chloro-1H-indole
2-Chloroindole

 

Chemical Formula: C8H6ClN
Exact Mass: 151.02
Molecular Weight: 151.59
m/z: 151.02 (100.0%), 153.02 (32.0%), 152.02 (9.0%), 154.02 (2.8%)

 

InChI:InChI=1S/C8H6ClN/c9-8-5-6-3-1-2-4-7(6)10-8/h1-5,10H

InChI Key:HBZHNVUMFPGVHW-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C=C(N2)Cl

 

Thermal Properties Value Condition Note
Melting Point 73-76 °C   (2)IC
Melting Point 73-74 °C   (3)IC
Melting Point 72-76 °C   (4)CAS
Melting Point 72-73 °C   (5)IC

Specification

98%
References
  1. (2) Bergman, Jan; Journal of Heterocyclic Chemistry 1977, V14(7), P1123-34 CAPLUS
  2. (3) Budylin, V. A.; Khimiya Geterotsiklicheskikh Soedinenii 1981, (11), P1494-6 CAPLUS
  3. (4) Powers, James C.; Journal of Organic Chemistry 1966, V31(8), P2627-31 CAPLUS
  4. (5) Budylin, V. A.; Khimiya Geterotsiklicheskikh Soedinenii 1981, (11), P1503-5 CAPLUS
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