21224-53-3

21224-53-3 structure

21224-53-3 structure

Name: 1-methoxy-2-[3-(2-sulfosulfanylethylamino)propyl]benzene
Chemical Name: 1-methoxy-2-[3-(2-sulfosulfanylethylamino)propyl]benzene
CAS Number: 21224-53-3
Molecular Formula: C₁₂H₁₉NO₄S₂
Molecular Weight: 305.41400
Create Date: 2016-05-19 22:35:19
Modify Date: 2024-01-20 15:34:02

Name	1-methoxy-2-[3-(2-sulfosulfanylethylamino)propyl]benzene

Density	1.288g/cm3
Molecular Formula	C₁₂H₁₉NO₄S₂
Molecular Weight	305.41400
Exact Mass	305.07600
PSA	109.31000
LogP	3.22510
Index of Refraction	1.574

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KJ2075100

CHEMICAL NAME :: Ethanethiol, 2-(3-(o-methoxyphenyl)propyl)amino-, hydrogen sulfate (ester)

CAS REGISTRY NUMBER :: 21224-53-3

LAST UPDATED :: 199007

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H19-N-O4-S2

MOLECULAR WEIGHT :: 305.44

WISWESSER LINE NOTATION :: WSQS2M3R BO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 175 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1190,1968