9-fluoro-5H-benzo[b][1,4]benzoxazepin-6-one

Names

[ CAS No. ]:
109790-32-1

[ Name ]:
9-fluoro-5H-benzo[b][1,4]benzoxazepin-6-one

[Synonym ]:
3-fluoro-10H-dibenzo[b,f][1,4]oxazepin-11-one
Dibenz(b,f)(1,4)oxazepin-11(10H)-one,3-fluoro
2-Fluor-dibenzoxazepin
3-Fluorodibenz(b,f)(1,4)oxazepin-11(10H)-one

Chemical & Physical Properties

[ Density]:
1.335g/cm3

[ Boiling Point ]:
286.2ºC at 760mmHg

[ Molecular Formula ]:
C13H8FNO2

[ Molecular Weight ]:
229.20700

[ Flash Point ]:
126.9ºC

[ Exact Mass ]:
229.05400

[ PSA ]:
41.82000

[ LogP ]:
3.00330

[ Vapour Pressure ]:
0.00268mmHg at 25°C

[ Index of Refraction ]:
1.602

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
HQ4050000
CHEMICAL NAME :
Dibenz(b,f)(1,4)oxazepin-11(10H)-one, 3-fluoro-
CAS REGISTRY NUMBER :
109790-32-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H8-F-N-O2
MOLECULAR WEIGHT :
229.22

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 22,161,1987

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 9-Hydroxydibenz[b,f][1,4]oxazepin-11(10H)-one
  • 2-Chloro-9-nitro-dibenz[b,f][1,4]oxazepin-11(10H)-one
  • 2,4-dimethyl-5H-benzo[b][1,4]benzoxazepin-6-one
  • 8-amino-4-methyl-5H-benzo[b][1,4]benzoxazepin-6-one
  • 8-amino-3-chloro-5H-benzo[b][1,4]benzoxazepin-6-one
  • 8-amino-3-methyl-5H-benzo[b][1,4]benzoxazepin-6-one
  • 2-chloro-1-[1-(ethanesulfonyl)-2,3-dihydro-1H-indol-5-yl]ethan-1-ol
  • 2-chloro-1-(1-methanesulfonyl-2,3-dihydro-1H-indol-5-yl)ethan-1-ol
  • 2-[(tert-Butoxy)carbonyl]-6-(trifluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxylic acid
  • 6-(Trifluoromethyl)-2-azabicyclo[3.1.0]hexane-3-carboxylic acid
  • (3-Aminomethyl-1H-indol-6-YL)-carbamic acid tert-butyl ester
  • (5-Bromothien-2-YL)methyl pentafluoroethyl ether
  • {[2-(4-Chlorophenyl)phenyl]methyl}(propan-2-yl)amine
  • 5-Methyl-2-phenyl-4-thiazoleacetyl chloride
  • 3-(2-Chloro-pyridin-4-yl)-5-nitro-1-trityl-1H-indazole
  • Alanine, 3-(o-chlorophenyl)-2-methyl-, ethyl ester
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