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

  • 4-[11,12-Dimethyl-10-(pyridin-3-ylmethyl)-3,5,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,7,11-pentaen-4-yl]-N,N-dimethylaniline
  • 4-tert-butyl-2',3',9',10'-tetrahydrospiro[cyclohexane-1,8'-cyclopenta[c]pyrano[3,2-g]chromen]-4'(1'H)-one
  • 2-(8,9-dimethyl-7-phenyl-7H-pyrrolo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)phenyl methyl ether
  • 2-{1-[(4-fluorophenyl)sulfonyl]pyrrolidin-2-yl}-1H-benzimidazole
  • N-(butan-2-yl)-5-chloro-2-(ethylsulfanyl)pyrimidine-4-carboxamide
  • 5-chloro-N-(2-chlorobenzyl)-2-(methylsulfanyl)pyrimidine-4-carboxamide
  • 2,4-dichlorobenzyl 5,5-dioxido-1-phenyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-2-yl sulfide
  • 2'-Methylspiro[4,17-dioxatetracyclo[8.7.0.03,8.011,15]heptadeca-1(10),2,8,11(15)-tetraene-5,1'-cyclohexane]-16-one
  • 7-(2-(4-(2-hydroxyethyl)piperazin-1-yl)ethoxy)-3-(4-methoxyphenyl)-4H-chromen-4-one
  • N-[3-cyano-4,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-2-yl]-2-(2-methoxyphenoxy)acetamide
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