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CAS Number: 200195-19-3
3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-carbaldehyde

Structure

 3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-carbaldehyde
Name: 3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-carbaldehyde
Synonyms:
General Information
Product Number: 200195193

CAS Registry Number 200195-19-3
Name:
2H-?1,?4-?Benzoxazine-?7-?carboxaldehyde, 3,?4-?dihydro-?3-?oxo-

 

Chemical Formula: C9H7NO3
Exact Mass: 177.04
Molecular Weight: 177.16
m/z: 177.04 (100.0%), 178.05 (9.9%), 179.05 (1.1%)

 

InChI:InChI=1S/C9H7NO3/c11-4-6-1-2-7-8(3-6)13-5-9(12)10-7/h1-4H,5H2,(H,10,12)

InChI Key:YCIZZCSWMNUTGR-UHFFFAOYSA-N

Canonical SMILES:C1C(=O)NC2=C(O1)C=C(C=C2)C=O

 

Thermal Properties Value Condition Note
Melting Point 220-222 °C   (2)CAS
Melting Point 218-221 °C   (1)CAS

Specification

98%
References
  1. (1) Anderluh, Petra Stefanic; Journal of Medicinal Chemistry 2005, V48(9), P3110-3113 CAPLUS
  2. (2) Belliotti, Thomas R.; Journal of Medicinal Chemistry 1999, V42(25), P5181-5187 CAPLUS
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