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CAS Number: 57045-85-9
N-(2-bromo-4-chlorophenyl)acetamide

Structure

N-(2-bromo-4-chlorophenyl)acetamide
Name: N-(2-bromo-4-chlorophenyl)acetamide
Synonyms:
General Information
Product Number: 57045859

CAS Registry Number 57045-85-9
Name:
Acetamide, N-​(2-​bromo-​4-​chlorophenyl)​-
2'-Bromo-4'-chloroacetanilide
NSC 136497

 

Chemical Formula: C8H7BrClNO
Exact Mass: 246.94
Molecular Weight: 248.50
m/z: 248.94 (100.0%), 246.94 (77.2%), 250.93 (24.0%), 249.94 (8.8%), 247.94 (7.0%), 251.94 (2.1%)

 

InChI:InChI=1S/C8H7BrClNO/c1-5(12)11-8-3-2-6(10)4-7(8)9/h2-4H,1H3,(H,11,12)

InChI Key:FXRJRUAYMSVQKU-UHFFFAOYSA-N

Canonical SMILES:CC(=O)NC1=C(C=C(C=C1)Cl)Br

 

Thermal Properties Value Condition Note
Melting Point 136-137 °C   (3)IC
Melting Point 136 °C Solv: ethanol (64-17-5) (4)CAS
Melting Point 133-134 °C Solv: dichloromethane (75-09-2); hexane (110-54-3) (5)IC

Specification

98%

References
  1. (3) Kakinami, Takaaki; Nippon Kagaku Kaishi 1990, (6), P705-8 CAPLUS
  2. (4) Cam-Van, N. T.; Tetrahedron 1964, V20(10), P2195-9 CAPLUS
  3. (5) Rudisill, Duane E.; Journal of Organic Chemistry 1989, V54(25), P5856-66 CAPLUS
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