2-(4-aminobenzoyl)oxyethyl-(4-methylpentan-2-yl)azanium chloride

Modify Date: 2025-09-17 21:39:59

2-(4-aminobenzoyl)oxyethyl-(4-methylpentan-2-yl)azanium chloride Structure
2-(4-aminobenzoyl)oxyethyl-(4-methylpentan-2-yl)azanium chloride structure
Common Name 2-(4-aminobenzoyl)oxyethyl-(4-methylpentan-2-yl)azanium chloride
CAS Number 69781-39-1 Molecular Weight 300.82400
Density 1.037g/cm3 Boiling Point 404.2ºC at 760 mmHg
Molecular Formula C15H25ClN2O2 Melting Point N/A
MSDS N/A Flash Point 198.2ºC

 Names

Name 2-(4-methylpentan-2-ylamino)ethyl 4-aminobenzoate,hydrochloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.037g/cm3
Boiling Point 404.2ºC at 760 mmHg
Molecular Formula C15H25ClN2O2
Molecular Weight 300.82400
Flash Point 198.2ºC
Exact Mass 300.16000
PSA 64.35000
LogP 4.22390
Index of Refraction 1.526
InChIKey SXGDDFKHOJXJPL-UHFFFAOYSA-N
SMILES CC(C)CC(C)[NH2+]CCOC(=O)c1ccc(N)cc1.[Cl-]

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG2352000
CHEMICAL NAME :
Benzoic acid, p-amino-, 2-((1,3-dimethylbutyl)amino)ethyl ester, hydrochloride
CAS REGISTRY NUMBER :
69781-39-1
LAST UPDATED :
199107
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H24-N2-O2.Cl-H
MOLECULAR WEIGHT :
300.87
WISWESSER LINE NOTATION :
ZR DVO2MY1&1Y1&1 &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 :
125 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 66,1448,1944

 Synonyms

4-Amino-benzoesaeure-[(1-methyl-hexylamino)-tert-butylester],Hydrochlorid
4-amino-benzoic acid-[2-(1,3-dimethyl-butylamino)-ethyl ester],hydrochloride
4-amino-benzoic acid-[(1-methyl-hexylamino)-tert-butyl ester],hydrochloride
4-Amino-benzoesaeure-[2-(1,3-dimethyl-butylamino)-aethylester],Hydrochlorid
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