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CAS Number: 7033-51-4
6-chloro-2-phenyl-4H-benzo[d][1,3]oxazin-4-one

Structure

6-chloro-2-phenyl-4H-benzo[d][1,3]oxazin-4-one
Name: 6-chloro-2-phenyl-4H-benzo[d][1,3]oxazin-4-one
Synonyms:
General Information
Product Number: 7033514

CAS Registry Number 7033-51-4
Name:
4H-​3,​1-​Benzoxazin-​4-​one, 6-​chloro-​2-​phenyl-
6-Chloro-2-phenylbenzo[d][1,3]oxazin-4-one

 

Chemical Formula: C14H8ClNO2
Exact Mass: 257.02
Molecular Weight: 257.67
m/z: 257.02 (100.0%), 259.02 (32.0%), 258.03 (15.3%), 260.02 (5.0%), 259.03 (1.5%)

 

InChI:InChI=1S/C14H8ClNO2/c15-10-6-7-12-11(8-10)14(17)18-13(16-12)9-4-2-1-3-5-9/h1-8H

InChI Key:RQDCQRFZYXJXMW-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=O)O2

 

Thermal Properties Value Condition Note
Melting Point 197-198 °C   (2)IC
Melting Point 196 °C   (3)CAS
Melting Point 196 °C   (4)IC
Melting Point 195-197 °C   (5)CAS
Melting Point 191-195 °C   (6)IC

Specification

98%

References
  1. (2) Misra, B. K.; Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry 1980, V19B(10), P908-11 CAPLUS
  2. (3) Legrand, Louis; Bulletin de la Societe Chimique de France 1960, P337-43 CAPLUS
  3. (4) Davis, Michael; Journal of Heterocyclic Chemistry 1977, V14(2), P267-8 CAPLUS
  4. (5) Desai, D. R.; Journal of the Indian Chemical Society 1966, V43(5), P351-5 CAPLUS
  5. (6) Eid, Attiat I.; European Journal of Medicinal Chemistry 1979, V14(5), P463-6 CAPLUS
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