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Substance Name: 2-Phenyl-3,1-benzoxazin-4-one
RN: 1022-46-4
UNII: F6R7D8UJO5
InChIKey: HTTLBYITFHMYFK-UHFFFAOYSA-N

Molecular Formula

  • C14-H9-N-O2

Molecular Weight

  • 223.23
 
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Names and Synonyms

Name of Substance

  • 2-Phenyl-3,1-benzoxazin-4-one

Synonyms

  • 2-Phenyl-3,1-benzoxazinone-(4)
  • AI3-61952
  • Bentranil
  • H-170
  • Linarotox
  • Linurotox
  • NSC 16082
  • UNII-F6R7D8UJO5

Systematic Name

  • 4H-3,1-Benzoxazin-4-one, 2-phenyl-

Registry Numbers

CAS Registry Number

  • 1022-46-4

FDA UNII

  • F6R7D8UJO5

System Generated Number

  • 0001022464

Structure Descriptors

InChI

1S/C14H9NO2/c16-14-11-8-4-5-9-12(11)15-13(17-14)10-6-2-1-3-7-10/h1-9H

InChIKey

HTTLBYITFHMYFK-UHFFFAOYSA-N

Smiles

c12c(nc(c3ccccc3)oc1=O)cccc2

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 123.5 deg C   EXP
log P (octanol-water) 3.400 (none)   EST
Water Solubility 5.5 mg/L 20 EXP
Atmospheric OH Rate Constant 2.39E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.