69780-97-8

69780-97-8 structure
69780-97-8 structure
  • Name: 2-(heptan-4-ylamino)butyl 4-aminobenzoate
  • Chemical Name: 1-(4-aminobenzoyl)oxybutan-2-yl-heptan-4-ylazanium,chloride
  • CAS Number: 69780-97-8
  • Molecular Formula: C18H31ClN2O2
  • Molecular Weight: 342.90400
  • Create Date: 2016-03-10 09:56:42
  • Modify Date: 2023-01-16 01:12:35

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

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