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CAS Number: 16732-64-2
4-bromo-1H-indole-2-carboxylic acid

Structure

 4-bromo-1H-indole-2-carboxylic acid
Name: 4-bromo-1H-indole-2-carboxylic acid
Synonyms:
General Information
Product Number: 16732642

CAS Registry Number 16732-64-2
Name:
1H-?Indole-?2-?carboxylic acid, 4-?bromo-
Indole-2-carboxylic acid, 4-bromo- (6CI,8CI)
4-Bromo-1H-indole-2-carboxylic acid
4-Bromoindole-2-carboxylic acid

 

Chemical Formula: C9H6BrNO2
Exact Mass: 238.96
Molecular Weight: 240.05
m/z: 238.96 (100.0%), 240.96 (98.1%), 239.96 (10.2%), 241.96 (9.6%)

 

InChI:InChI=1S/C9H6BrNO2/c10-6-2-1-3-7-5(6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)

InChI Key:SXFVRIRMDXONCT-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C(N2)C(=O)O)C(=C1)Br

 

Thermal Properties Value Condition Note
Melting Point 263 °C   (1)CAS
Melting Point See full text   (2)CAS

Specification

98%
References
  1. (1) Plieninger, Hans; Chemische Berichte 1955, V88, P370-6 CAPLUS
  2. (2) Barltrop, J. A.; Journal of the Chemical Society 1954, P3399-3403 CAPLUS
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