Thiosulfuric acid (H2S2O3), {S-[2-[(4-cyclohexylbutyl)amino]-2-iminoethyl]} ester

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Names

[ CAS No. ]:
40283-59-8

[ Name ]:
Thiosulfuric acid (H2S2O3), {S-[2-[(4-cyclohexylbutyl)amino]-2-iminoethyl]} ester

Chemical & Physical Properties

[ Density]:
1.33g/cm3

[ Molecular Formula ]:
C12H24N2O3S2

[ Molecular Weight ]:
308.46100

[ Exact Mass ]:
308.12300

[ PSA ]:
123.93000

[ LogP ]:
4.41130

[ Index of Refraction ]:
1.597

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
PB4801000
CHEMICAL NAME :
Methanethiol, (N-cyclohexylbutyl)amidino-, hydrogen thiosulfate
CAS REGISTRY NUMBER :
40283-59-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H24-N2-O3-S2
MOLECULAR WEIGHT :
308.50
WISWESSER LINE NOTATION :
L6TJ A4MYUM&1SSWQ

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 :
22 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: 15,1313,1972

Safety Information

[ HS Code ]:
2930909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-cyclohexylbutan-1-amine
  • 2-chloroacetonitrile

DownStream

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

  • 2-[2-Amino-5-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-5-[(2,5-dimethylbenzyl)oxy]phenol
  • 1-(3-(Bromomethyl)-2-(methylthio)phenyl)-2-chloropropan-1-one
  • 1-(5-(Bromomethyl)-2-(difluoromethyl)phenyl)-1-chloropropan-2-one
  • 2-(Oxolan-3-yl)azetidine hydrochloride
  • 5-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-1,2-dihydro-3H-pyrrol-3-one
  • 5-amino-4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1-[2-(2-fluorophenyl)ethyl]-1,2-dihydro-3H-pyrrol-3-one
  • 1-[2-(1-benzylpiperidin-4-yl)ethyl]-5-imino-4-(4-phenyl-1,3-thiazol-2-yl)-2,5-dihydro-1H-pyrrol-3-ol
  • 1-{3-[4-(Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]propyl}pyrrolidine
  • 5-amino-1-(1-benzylpiperidin-4-yl)-4-(4,5-dimethyl-1,3-thiazol-2-yl)-1,2-dihydro-3H-pyrrol-3-one
  • 5-amino-1-(morpholin-4-yl)-4-(4-phenyl-1,3-thiazol-2-yl)-1,2-dihydro-3H-pyrrol-3-one
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