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CAS Number: 116815-03-3
8-chloro-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one

Structure

 8-chloro-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one
Name: 8-chloro-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one
Synonyms:
General Information
Product Number: 116815033

CAS Registry Number 116815-03-3
Name:
5H-?1-?Benzazepin-?5-?one, 8-?chloro-?1,?2,?3,?4-?tetrahydro-

 

Chemical Formula: C10H10ClNO
Exact Mass: 195.05
Molecular Weight: 195.65
m/z: 195.05 (100.0%), 197.04 (32.0%), 196.05 (11.0%), 198.05 (3.5%)

 

InChI:InChI=1S/C10H10ClNO/c11-7-3-4-8-9(6-7)12-5-1-2-10(8)13/h3-4,6,12H,1-2,5H2

InChI Key:VYAYCHCHFQVJHU-UHFFFAOYSA-N

Canonical SMILES:C1CC(=O)C2=C(C=C(C=C2)Cl)NC1

 

Thermal Properties Value Condition Note
Melting Point 104 °C   (1)IC

Specification

98%
References
  1. (1) Ibrahim, El Sayed; European Journal of Medicinal Chemistry 1988, V23(2), P183-8 CAPLUS
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