a-(3-quinuclidinyl)benzhydrol

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Names

[ CAS No. ]:
10447-39-9

[ Name ]:
a-(3-quinuclidinyl)benzhydrol

[Synonym ]:
1-Azabicyclo[2.2.2]octane-3-methanol, α,α-diphenyl-
a,a-diphenyl-1-azabicyclo[2.2.2]octane-3-methanol
Quifenadine
(1-Aza-bicyclo[2.2.2]oct-3-yl)-diphenyl-methanol
a-(3-quinuclidinyl)benzhydrol
1-Azabicyclo[2.2.2]oct-3-yl(diphenyl)methanol
Diphenyl-3-quinuclidylcarbinol
Diphenyl-chinuclidin-3-yl-methanol
Chinuclidyl-3-diphenyl-carbinol
a,a-Diphenyl-3-quinuclidinemethanol

Chemical & Physical Properties

[ Density]:
1.2±0.1 g/cm3

[ Boiling Point ]:
430.2±30.0 °C at 760 mmHg

[ Melting Point ]:
239ºC

[ Molecular Formula ]:
C20H24ClNO

[ Molecular Weight ]:
293.403

[ Flash Point ]:
208.0±23.2 °C

[ Exact Mass ]:
293.177979

[ PSA ]:
23.47000

[ LogP ]:
3.63

[ Vapour Pressure ]:
0.0±1.1 mmHg at 25°C

[ Index of Refraction ]:
1.641

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VD4824600
CHEMICAL NAME :
3-Quinuclidinemethanol, alpha,alpha-diphenyl-
CAS REGISTRY NUMBER :
10447-39-9
BEILSTEIN REFERENCE NO. :
1542055
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H23-N-O
MOLECULAR WEIGHT :
293.44
WISWESSER LINE NOTATION :
T66 A B CNTJ AXQR&R

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 :
62 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 10,748,1976

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • Benzenemethanol, a-(3,4-dimethoxyphenyl)-3,4-dimethoxy-
  • Pancopride
  • Benzhydrol, a-[3-(diethylamino)propyl]- (8CI)
  • glepidotin A
  • Benzeneethanamine, a-(3-methoxyphenyl)-N-(phenylmethyl)-
  • S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 3-phenoxybenzenecarbothioate
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 6-Bromo-1-chloro-2-(methoxymethoxy)naphthalene
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 4-Cyclopropyl-6-(4-{[4-(4-methylpiperazin-1-yl)but-2-yn-1-yl]oxy}piperidin-1-yl)pyrimidine
  • N-[5-(dimethylcarbamoyl)-4-methyl-1,3-thiazol-2-yl]-5-fluoro-4-methylpyridine-2-carboxamide
  • 3-Tert-butyl-1-[(6-hydroxy-1,4-dithiepan-6-yl)methyl]urea
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (3-Methoxy-4-prop-2-enoyloxyphenyl)methyl prop-2-enoate
  • CID 145867924