1-Propanone,1-(4-fluorophenyl)-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride (1:1)
Names
[ CAS No. ]:
27922-11-8
[ Name ]:
1-Propanone,1-(4-fluorophenyl)-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride (1:1)
[Synonym ]:
3-(azepan-1-yl)-1-(4-fluorophenyl)propan-1-one hydrochloride(1:1)
Propiophenone,4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-,hydrochloride
4'-Fluoro-3-(1-hexamethyleneimino)propiophenone hydrochloride
Chemical & Physical Properties
[ Density]:
1.07g/cm3
[ Boiling Point ]:
367.6ºC at 760 mmHg
[ Molecular Formula ]:
C15H21ClFNO
[ Molecular Weight ]:
285.78500
[ Flash Point ]:
176.1ºC
[ Exact Mass ]:
285.13000
[ PSA ]:
20.31000
[ LogP ]:
4.01440
[ Vapour Pressure ]:
1.35E-05mmHg at 25°C
[ Index of Refraction ]:
1.514
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UH1766500
- CHEMICAL NAME :
- Propiophenone, 4'-fluoro-3-(hexahydro-1H-azepin-1-yl)-, hydrochloride
- CAS REGISTRY NUMBER :
- 27922-11-8
- LAST UPDATED :
- 199112
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C15-H20-F-N-O.Cl-H
- MOLECULAR WEIGHT :
- 285.82
- WISWESSER LINE NOTATION :
- T7NTJ A2VR DF &GH
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 190 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 13,480,1970