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CAS Number: 76903-88-3
3,4-difluorobenzoyl chloride

Structure

3,4-difluorobenzoyl chloride
Name: 3,4-difluorobenzoyl chloride
Synonyms:
General Information
Product Number: 76903883

CAS Registry Number 76903-88-3
Name:
Benzoyl chloride, 3,​4-​difluoro-
3,4-Difluorobenzoyl chloride

 

Chemical Formula: C7H3ClF2O
Exact Mass: 175.98
Molecular Weight: 176.55
m/z: 175.98 (100.0%), 177.98 (32.0%), 176.99 (7.6%), 178.98 (2.4%)

 

InChI:InChI=1S/C7H3ClF2O/c8-7(11)4-1-2-5(9)6(10)3-4/h1-3H

InChI Key:RPQWXGVZELKOEU-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=C(C=C1C(=O)Cl)F)F

 

Thermal Properties Value Condition Note
Boiling Point 61-63 °C Press: 15 Torr (1)IC
Melting Point 53-54 °C   (3)CAS

Specification

98%

References
  1. (1) Anderson, Wayne K.; Journal of Medicinal Chemistry 1982, V25(1), P84-6 CAPLUS
  2. (3) Tran, Huu-Anh; Organic & Biomolecular Chemistry 2011, V9(10), P3658-3671 CAPLUS
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