2-(heptan-4-ylamino)butyl 4-aminobenzoate

Modify Date: 2023-01-16 01:12:35

2-(heptan-4-ylamino)butyl 4-aminobenzoate Structure
2-(heptan-4-ylamino)butyl 4-aminobenzoate structure
Common Name 2-(heptan-4-ylamino)butyl 4-aminobenzoate
CAS Number 69780-97-8 Molecular Weight 342.90400
Density 1.007g/cm3 Boiling Point 443.2ºC at 760 mmHg
Molecular Formula C18H31ClN2O2 Melting Point N/A
MSDS N/A Flash Point 221.8ºC

 Names

Name 1-(4-aminobenzoyl)oxybutan-2-yl-heptan-4-ylazanium,chloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.007g/cm3
Boiling Point 443.2ºC at 760 mmHg
Molecular Formula C18H31ClN2O2
Molecular Weight 342.90400
Flash Point 221.8ºC
Exact Mass 342.20700
PSA 64.35000
LogP 5.53670
Index of Refraction 1.517

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DG3068000
CHEMICAL NAME :
Benzoic acid, p-amino-, 2-(1-propylbutylamino)butyl ester, hydrochloride
CAS REGISTRY NUMBER :
69780-97-8
LAST UPDATED :
199012
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C18-H30-N2-O2.Cl-H
MOLECULAR WEIGHT :
342.96
WISWESSER LINE NOTATION :
ZR DVO1Y2&MY3&3 &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 :
250 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
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
30 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

 Synonyms

BENZOIC ACID,p-AMINO-,2-(1-PROPYLBUTYLAMINO)BUTYL ESTER,HYDROCHLORIDE
4-amino-benzoic acid-[2-(1-propyl-butylamino)-butyl ester],hydrochloride
p-Aminobenzoic acid 2-(1-propylbutylamino)butyl ester hydrochloride
1-(4-aminobenzoyl)oxybutan-2-yl-heptan-4-ylazanium chloride
N-{1-[(4-aminobenzoyl)oxy]butan-2-yl}heptan-4-aminium chloride
4-Amino-benzoesaeure-[2-(1-propyl-butylamino)-butylester],Hydrochlorid