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CAS Number: 17826-04-9
6-bromo-1H-indole-3-carbaldehyde

Structure

 6-bromo-1H-indole-3-carbaldehyde
Name: 6-bromo-1H-indole-3-carbaldehyde
Synonyms:
General Information
Product Number: 17826049

CAS Registry Number 17826-04-9
Name:
1H-?Indole-?3-?carboxaldehyde, 6-?bromo-
Indole-3-carboxaldehyde, 6-bromo- (8CI)
6-Bromo-1H-indole-3-carboxaldehyde
3-Formyl-6-bromo-1H-indole
6-Bromoindole-3-carbaldehyde
6-Bromoindole-3-carboxaldehyde

 

Chemical Formula: C9H6BrNO
Exact Mass: 222.96
Molecular Weight: 224.05
m/z: 222.96 (100.0%), 224.96 (97.3%), 223.97 (9.8%), 225.96 (9.8%)

 

InChI:InChI=1S/C9H6BrNO/c10-7-1-2-8-6(5-12)4-11-9(8)3-7/h1-5,11H

InChI Key:WCCLQCBKBPTODV-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1Br)NC=C2C=O

 

Thermal Properties Value Condition Note
Melting Point 201-203 °C   (3)IC
Melting Point 199-201 °C Solv: dichloromethane (75-09-2) (4)CAS
Melting Point See full text   (5)CAS

Specification

98%
References
  1. (3) Niwa, Haruki; Journal of Natural Products 1988, V51(2), P343-4 CAPLUS
  2. (4) Carletti, Isabelle; Journal of Natural Products 2000, V63(7), P981-983 CAPLUS
  3. (5) Da Settimo, Antonio; Gazzetta Chimica Italiana 1967, V97(8), P1304-16 CAPLUS
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