2-((4-(p-Bromophenyl)butyl)amino)ethanethiol, hydrogen sulfate (ester)

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Names

[ CAS No. ]:
38914-43-1

[ Name ]:
2-((4-(p-Bromophenyl)butyl)amino)ethanethiol, hydrogen sulfate (ester)

Chemical & Physical Properties

[ Density]:
1.498g/cm3

[ Molecular Formula ]:
C12H18BrNO3S2

[ Molecular Weight ]:
368.31000

[ Exact Mass ]:
366.99100

[ PSA ]:
100.08000

[ LogP ]:
4.36910

[ Index of Refraction ]:
1.601

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KJ0219000
CHEMICAL NAME :
Ethanethiol, 2-((4-(p-bromophenyl)butyl)amino)-, hydrogen sulfate (ester)
CAS REGISTRY NUMBER :
38914-43-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H18-Br-N-O3-S2
MOLECULAR WEIGHT :
368.34
WISWESSER LINE NOTATION :
WSQS2M4R DE

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 :
43 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: 15,968,1972

Safety Information

[ HS Code ]:
2930909090

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

  • Tert-butyl 1-piperidin-4-yltriazole-4-carboxylate
  • (2R)-5,5,5-Trifluoro-2,3,3-trimethylpentan-1-amine
  • (2S)-2-(1,3-Dihydro-2-benzofuran-1-yl)propan-1-amine
  • (2S)-3-Ethyl-2-methylhexan-1-amine
  • (2R)-2-(2,3-Dihydro-1,4-benzodioxin-3-yl)propan-1-amine
  • 5-(Bromomethyl)-3-(4-bromophenyl)-1,3-oxazolidin-2-one
  • Methyl 2-amino-2-(4-methylthiophen-2-yl)acetate
  • Tert-butyl 2-amino-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
  • Tert-butyl 5-amino-1-tert-butylpyrazole-4-carboxylate
  • Tert-butyl 4-amino-3-methylthieno[2,3-c][1,2]thiazole-5-carboxylate
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