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CAS Number: 67805-67-8
8-bromoquinolin-2(1H)-one

Structure

 8-bromoquinolin-2(1H)-one
Name: 8-bromoquinolin-2(1H)-one
Synonyms:
General Information
Product Number: 67805678

CAS Registry Number 67805-67-8
Name:
2(1H)?-?Quinolinone, 8-?bromo-
8-Bromo-2(1H)-quinolinone
8-Bromo-2-quinolone
8-Bromocarbostyril
8-Bromoquinolin-2-ol

 

Chemical Formula: C9H6BrNO
Exact Mass: 222.96
Molecular Weight: 224.05
m/z: 222.96 (100.0%), 224.96 (97.3%), 223.97 (9.8%), 225.96 (9.8%)

 

InChI:InChI=1S/C9H6BrNO/c10-7-3-1-2-6-4-5-8(12)11-9(6)7/h1-5H,(H,11,12)

InChI Key:HGJBIJWBYATVQY-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C(=C1)Br)NC(=O)C=C2

 

Thermal Properties Value Condition Note
Melting Point 196-198 °C   (2)CAS
Melting Point 194-196 °C Solv: ethanol (64-17-5) (1)CAS
Melting Point 182-185 °C Solv: ethanol (64-17-5) (3)CAS

Specification

98%
References
  1. (1) Lord, Anna-Marie; Journal of Medicinal Chemistry 2009, V52(3), P868-877 CAPLUS
  2. (2) Cottet, Fabrice; European Journal of Organic Chemistry 2003, (8), P1559-1568 CAPLUS
  3. (3) Wickramasinghe, Lanka D.; Journal of the American Chemical Society 2015, V137(41), P13260-13263 CAPLUS
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