(8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-(3-chlorophenyl)prop-2-enoate,chloride

Names

[ CAS No. ]:
64048-74-4

[ Name ]:
(8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-(3-chlorophenyl)prop-2-enoate,chloride

[Synonym ]:
ATROPIC ACID,3'-CHLORO-,3-TROPANYL ESTER,HYDROCHLORIDE
3'-Chloroatropic acid,3-tropanyl ester,hydrochloride
3-Tropanyl 3'-chloroatropate hydrochloride
(8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-(3-chlorophenyl)prop-2-enoate chloride

Chemical & Physical Properties

[ Boiling Point ]:
421.1ºC at 760 mmHg

[ Molecular Formula ]:
C17H21Cl2NO2

[ Molecular Weight ]:
342.26000

[ Flash Point ]:
208.5ºC

[ Exact Mass ]:
341.09500

[ PSA ]:
29.54000

[ LogP ]:
4.26150

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CK0155000
CHEMICAL NAME :
Atropic acid, 3'-chloro-, 3-tropanyl ester, hydrochloride
CAS REGISTRY NUMBER :
64048-74-4
LAST UPDATED :
199107
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H20-Cl-N-O2.Cl-H
MOLECULAR WEIGHT :
342.29
WISWESSER LINE NOTATION :
T56 A ANTJ A1 GOVYU1&R CG &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
135 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: 12,477,1969

Related Compounds

  • 3-(4,5-diiodo-2-methyl-1H-imidazol-1-yl)pyridine-4-carbaldehyde
  • 3-[3-(propan-2-yl)-1H-1,2,4-triazol-1-yl]pyridine-4-carbaldehyde
  • 5-(4-cyclopropyl-1H-pyrazol-1-yl)pyridine-3-carbaldehyde
  • 3-(3,3-Difluoropyrrolidin-1-yl)-4-(propan-2-yl)cyclohexan-1-ol
  • 5-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)-1-methyl-1H-pyrazole-4-carbaldehyde
  • 2-bromo-6-(4,5-diiodo-1H-imidazol-1-yl)benzaldehyde
  • 2-{1-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclopentanecarbonyl}-2-azabicyclo[2.1.1]hexane-5-carboxylic acid
  • 3-(2-ethyl-4-methyl-1H-imidazol-1-yl)pyridine-4-carbaldehyde
  • 4-(Benzyloxy)-3-hydroxy-2,2,3-trimethylbutanoic acid
  • 2-(3-Hydroxy-4-methyloxolan-3-yl)acetic acid
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