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

Names

[ CAS No. ]:
21224-53-3

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

Chemical & Physical Properties

[ 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

Toxicological Information

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

Related Compounds

  • (2S,3R)-2-{cyclopropyl[(prop-2-en-1-yloxy)carbonyl]amino}-3-hydroxybutanoic acid
  • 2-(4-{[(Prop-2-en-1-yloxy)carbonyl]amino}oxan-4-yl)acetic acid
  • 2-(Oxan-4-yl)-2-{[(prop-2-en-1-yloxy)carbonyl]amino}acetic acid
  • 2,2,5-Trimethyl-3-[(prop-2-en-1-yloxy)carbonyl]-1,3-oxazolidine-4-carboxylic acid
  • 6-(N-methylacetamido)naphthalene-2-carboxylic acid
  • 1-acetyl-1H,2H,3H-pyrrolo[2,3-b]pyridine-6-carboxylic acid
  • 1-acetyl-1H,2H,3H-pyrrolo[3,2-b]pyridine-6-carboxylic acid
  • Ethyl 4-aminopyrrolo[2,1-f][1,2,4]triazine-7-carboxylate
  • 1-[(3aR,6aS)-5-acetyl-octahydropyrrolo[3,4-c]pyrrol-2-yl]prop-2-yn-1-one
  • rac-(3R,4S)-4-(4-methoxyphenyl)piperidin-3-amine
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