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CAS Number: 399-00-8
5-bromo-4-fluoro-2-hydroxybenzaldehyde

Structure

5-bromo-4-fluoro-2-hydroxybenzaldehyde
Name: 5-bromo-4-fluoro-2-hydroxybenzaldehyde
Synonyms:
General Information
Product Number: 399008
CAS Registry Number:
399-00-8
Name:
Benzaldehyde, 5-​bromo-​4-​fluoro-​2-​hydroxy-
Salicylaldehyde, 5-​bromo-​4-​fluoro- (8CI); 4-​Fluoro-​5-​bromo-​2-​hydroxybenzaldehyde; 5-​Bromo-​4-​fluoro-​2-​hydroxybenzaldehyde 
 
Chemical Formula: C7H4BrFO2
Exact Mass: 217.94
Molecular Weight: 219.01
m/z: 217.94 (100.0%), 219.94 (97.9%), 218.94 (7.7%), 220.94 (7.5%)
Elemental Analysis: C, 38.39; H, 1.84; Br, 36.48; F, 8.67; O, 14.61
 
InChI: InChI=1S/C7H4BrFO2/c8-5-1-4(3-10)7(11)2-6(5)9/h1-3,11H
InChIKey: QKTZGVUIYFBODQ-UHFFFAOYSA-N
Canonical SMILES : C1=C(C(=CC(=C1Br)F)O)C=O
 
Thermal Properties Value Condition Note
Melting Point 81 °C   (2)CAS

Specification

98%

References
  1. (1) Carroll, William A.; Journal of Medicinal Chemistry 2004, V47(12), P3163-3179 CAPLUS
  2. (2) Hodgson, Herbert H.; Journal of the Chemical Society 1929, P1632-9 CAPLUS
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