Benzenesulfonothioicacid, 4-methyl-, S-(trichloromethyl) ester

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Names

[ CAS No. ]:
13029-18-0

[ Name ]:
Benzenesulfonothioicacid, 4-methyl-, S-(trichloromethyl) ester

[Synonym ]:
S-Trichloromethyl p-toluenethiosulfonate
p-Toluenesulfonic acid,thio-,S-trichloromethyl ester
Toluol-4-thiosulfonsaeure-S-trichlormethylester
toluene-4-thiosulfonic acid S-trichloromethyl ester
S-Trichlormethyl-p-toluolthiosulfonat
p-Toluenesulfonic acid,S-trichloromethyl ester

Chemical & Physical Properties

[ Density]:
1.562g/cm3

[ Boiling Point ]:
326.2ºC at 760mmHg

[ Molecular Formula ]:
C8H7Cl3O2S2

[ Molecular Weight ]:
305.62900

[ Flash Point ]:
151.1ºC

[ Exact Mass ]:
303.89500

[ PSA ]:
67.82000

[ LogP ]:
4.82540

[ Vapour Pressure ]:
0.000416mmHg at 25°C

[ Index of Refraction ]:
1.604

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XT7358800
CHEMICAL NAME :
p-Toluenesulfonic acid, thio-, S-trichloromethyl ester
CAS REGISTRY NUMBER :
13029-18-0
BEILSTEIN REFERENCE NO. :
2381302
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H7-Cl3-O2-S2
MOLECULAR WEIGHT :
305.62
WISWESSER LINE NOTATION :
GXGGSSWR D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04603

Related Compounds

  • 4A-(methoxymethyl)octahydro-2H-pyrano[3,2-c]pyridine
  • 4A-((pyridin-2-yloxy)methyl)octahydro-2H-pyrano[3,2-c]pyridine
  • 1,4-Dimethyl-1,4,9-triazaspiro[5.5]undecan-5-one
  • N-(6-Azaspiro[2.5]octan-1-ylmethyl)methanesulfonamide
  • 2-(3-Methoxybenzyl)-2,7-diazaspiro[4.4]nonan-1-one
  • 3-(3-Oxo-2,7-diazaspiro[4.4]nonan-2-yl)benzonitrile
  • N-((6,7,8,9-Tetrahydro-5H-imidazo[1,2-d][1,4]diazepin-3-yl)methyl)methanesulfonamide
  • 3,8-Diazabicyclo[3.2.1]octan-8-yl(furan-2-yl)methanone
  • (2-(Pyridin-4-ylmethyl)-2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-4-yl)methanol
  • N,N,4-Trimethyl-5,7-dihydrospiro[pyrano[4,3-d]pyrimidine-8,3'-pyrrolidin]-2-amine
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