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CAS Number: 56962-04-0
3-bromo-5-chlorophenol

Structure

 3-bromo-5-chlorophenol
Name: 3-bromo-5-chlorophenol
Synonyms:
General Information
Product Number: 56962040

CAS Registry Number 56962-04-0
Name:
Phenol, 3-?bromo-?5-?chloro-
3-Bromo-5-chlorophenol

 

Chemical Formula: C6H4BrClO
Exact Mass: 205.91
Molecular Weight: 207.45
m/z: 207.91 (100.0%), 205.91 (77.4%), 209.91 (24.1%), 208.91 (6.5%), 206.92 (5.1%), 210.91 (1.6%)

 

InChI:InChI=1S/C6H4BrClO/c7-4-1-5(8)3-6(9)2-4/h1-3,9H

InChI Key:GMGWXLPFRHYWAS-UHFFFAOYSA-N

Canonical SMILES:C1=C(C=C(C=C1Cl)Br)O

 

Thermal Properties Value Condition Note
Boiling Point 256-260 °C Press: 756 Torr (1)CAS
Boiling Point 256 °C   (2)SRC
Melting Point 70 °C   (3)CAS
Melting Point 70 °C   (2)SRC
Melting Point 68-69 °C   (1)CAS
Melting Point 68-69 °C   (4)CAS

Specification

98%
References
  1. (1) Kohn, M.; Monatshefte fuer Chemie 1926, V47, P367-77 CAPLUS
  2. (2) "PhysProp" data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
  3. (3) Hodgson, H. H.; Journal of the Chemical Society 1926, P2077-9 CAPLUS
  4. (4) Davidson, James P.; Organic Process Research & Development 2010, V14(2), P477-480 CAPLUS
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