1-benzoyloxybutan-2-yl-propan-2-yl-azanium chloride

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Names

[ CAS No. ]:
67032-13-7

[ Name ]:
1-benzoyloxybutan-2-yl-propan-2-yl-azanium chloride

[Synonym ]:
(2-(benzoyloxy)ethyl)dimethylammonium chloride
2-(N,N-dimethylamino)ethyl benzoate
1-Benzoyloxy-2-dimethylamino-aethan,Hydrochlorid
1-Benzoyloxy-2-isobutylamino-2-methyl-propan,Hydrochlorid
1-Benzoyloxy-2-isopropylamino-butan,Hydrochlorid
Benzoic acid,2-(dimethylamino)ethyl ester
2-(Dimethylaminoethyl)benzoate
1-benzoyloxy-2-isopropylamino-butane,hydrochloride
1-benzoyloxy-2-dimethylamino-ethane,hydrochloride
1-benzoyloxy-2-isobutylamino-2-methyl-propane,hydrochloride

Chemical & Physical Properties

[ Boiling Point ]:
329.5ºC at 760 mmHg

[ Molecular Formula ]:
C14H22ClNO2

[ Molecular Weight ]:
271.78300

[ Flash Point ]:
153.1ºC

[ Exact Mass ]:
271.13400

[ PSA ]:
38.33000

[ LogP ]:
3.81290

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH3120000
CHEMICAL NAME :
Benzoic acid, 2-(isopropylamino)butyl ester, hydrochloride
CAS REGISTRY NUMBER :
67032-13-7
LAST UPDATED :
199303
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C14-H21-N-O2.Cl-H
MOLECULAR WEIGHT :
271.82
WISWESSER LINE NOTATION :
1Y1&MY2&1OVR &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 90,181,1947
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
60 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 90,181,1947

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Benzoyl chloride

DownStream

Related Compounds

  • Methyl 2-(3,5-dimethylpiperidin-1-yl)-3-nitropyridine-4-carboxylate
  • Methyl 2-(4-methylpiperidin-1-yl)-3-nitropyridine-4-carboxylate
  • Methyl 2-[4-(2-methylpropyl)piperazin-1-yl]-3-nitropyridine-4-carboxylate
  • Methyl 2-[4-(2-methoxyethyl)piperazin-1-yl]-3-nitropyridine-4-carboxylate
  • Tert-butyl 4-[4-(methoxycarbonyl)-3-nitropyridin-2-yl]piperazine-1-carboxylate
  • Methyl 2-(4,4-dimethylpiperidin-1-yl)-3-nitropyridine-4-carboxylate
  • 3-Amino-2-[4-(2-methoxyethyl)piperazin-1-yl]pyridine-4-carboxylic acid
  • 2-(1H-imidazol-4-yl)-5-methoxyphenol
  • 2-(cyclopropylamino)-3-(3-methyl-1H-pyrazol-1-yl)butanoic acid
  • 2-(cyclopropylamino)-3-(4-methyl-1H-pyrazol-1-yl)butanoic acid
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