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

Modify Date: 2023-01-16 11:43:23

1-benzoyloxybutan-2-yl-propan-2-yl-azanium chloride Structure
1-benzoyloxybutan-2-yl-propan-2-yl-azanium chloride structure
Common Name 1-benzoyloxybutan-2-yl-propan-2-yl-azanium chloride
CAS Number 67032-13-7 Molecular Weight 271.78300
Density N/A Boiling Point 329.5ºC at 760 mmHg
Molecular Formula C14H22ClNO2 Melting Point N/A
MSDS N/A Flash Point 153.1ºC

 Names

Name Benzoic acid, 2-(isopropylamino)butyl ester, hydrochloride
Synonym More Synonyms

 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

~%

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

1-benzoyloxybut...

CAS#:67032-13-7

Literature: Sharp and Dohme Inc. Patent: DE837848 , 1951 ; DRP/DRBP Org.Chem.

 Precursor & DownStream

Precursor  1

DownStream  0

 Synonyms

(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