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CAS Number: 3951-89-1
7-bromo-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one

Structure

 7-bromo-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one
Name: 7-bromo-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one
Synonyms:
General Information
Product Number: 3951891

CAS Registry Number 3951-89-1
Name:
5H-?1-?Benzazepin-?5-?one, 7-?bromo-?1,?2,?3,?4-?tetrahydro-

 

Chemical Formula: C10H10BrNO
Exact Mass: 238.99
Molecular Weight: 240.10
m/z: 238.99 (100.0%), 240.99 (97.3%), 240.00 (11.0%), 242.00 (10.7%)

 

InChI:InChI=1S/C10H10BrNO/c11-7-3-4-9-8(6-7)10(13)2-1-5-12-9/h3-4,6,12H,1-2,5H2

InChI Key:XIFKOJPBXZKSAZ-UHFFFAOYSA-N

Canonical SMILES:C1CC(=O)C2=C(C=CC(=C2)Br)NC1

 

Thermal Properties Value Condition Note
Melting Point 107 °C   (2)CAS

Specification

98%
References
  1. (2) Bell, W. H.; Journal of the Chemical Society 1964, (Dec.), P4926-30 CAPLUS
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