4-Fluorophenyl-1-methylene-2-(4-carbethoxy-4-phenylpiperidino)-ethyl k etone hydrochloride

Modify Date: 2024-01-31 10:47:56

4-Fluorophenyl-1-methylene-2-(4-carbethoxy-4-phenylpiperidino)-ethyl k etone hydrochloride Structure
4-Fluorophenyl-1-methylene-2-(4-carbethoxy-4-phenylpiperidino)-ethyl k etone hydrochloride structure
Common Name 4-Fluorophenyl-1-methylene-2-(4-carbethoxy-4-phenylpiperidino)-ethyl k etone hydrochloride
CAS Number 102395-64-2 Molecular Weight 431.92700
Density N/A Boiling Point 514ºC at 760mmHg
Molecular Formula C24H27ClFNO3 Melting Point N/A
MSDS N/A Flash Point 264.7ºC

 Names

Name ethyl 1-[2-(4-fluorobenzoyl)prop-2-enyl]-4-phenylpiperidin-1-ium-4-carboxylate,chloride
Synonym More Synonyms

 Chemical & Physical Properties

Boiling Point 514ºC at 760mmHg
Molecular Formula C24H27ClFNO3
Molecular Weight 431.92700
Flash Point 264.7ºC
Exact Mass 431.16600
PSA 46.61000
LogP 4.90140
Vapour Pressure 1.12E-10mmHg at 25°C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NS5382000
CHEMICAL NAME :
Isonipecotic acid, 1-(2-(p-fluorobenzoyl)allyl)-4-phenyl-, ethyl ester, hydrochloride
CAS REGISTRY NUMBER :
102395-64-2
LAST UPDATED :
199012
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C24-H26-F-N-O3.Cl-H
MOLECULAR WEIGHT :
431.97
WISWESSER LINE NOTATION :
T6NTJ A1YU1&VR DF& DVO2 DR &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#11085

 Synonyms

4-(ethoxycarbonyl)-1-[2-(4-fluorobenzoyl)prop-2-en-1-yl]-4-phenylpiperidinium chloride
4-Fluorophenyl-1-methylene-2-(4-carbethoxy-4-phenylpiperidino)-ethyl ketone hydrochloride
1-(2-(p-Fluorobenzoyl)allyl)-4-phenylisonipecotic acid ethyl ester hydrochloride
ethyl 1-[2-(4-fluorobenzoyl)prop-2-enyl]-4-phenylpiperidin-1-ium-4-carboxylate chloride
Isonipecotic acid,1-(2-(p-fluorobenzoyl)allyl)-4-phenyl-,ethyl ester,hydrochloride