Benzenecarbothioicacid, S-(4-bromophenyl) ester

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Names

[ CAS No. ]:
28122-80-7

[ Name ]:
Benzenecarbothioicacid, S-(4-bromophenyl) ester

[Synonym ]:
S-4-bromophenyl benzothioate
4-substituted phenylthiol benzoate
WLN: ER DSVR

Chemical & Physical Properties

[ Density]:
1.53g/cm3

[ Boiling Point ]:
364.9ºC at 760mmHg

[ Molecular Formula ]:
C13H9BrOS

[ Molecular Weight ]:
293.17900

[ Flash Point ]:
174.5ºC

[ Exact Mass ]:
291.95600

[ PSA ]:
42.37000

[ LogP ]:
4.38160

[ Vapour Pressure ]:
1.62E-05mmHg at 25°C

[ Index of Refraction ]:
1.677

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH6852000
CHEMICAL NAME :
Benzoic acid, thio-, S-(p-bromophenyl) ester
CAS REGISTRY NUMBER :
28122-80-7
BEILSTEIN REFERENCE NO. :
1961381
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H9-Br-O-S
MOLECULAR WEIGHT :
293.19
WISWESSER LINE NOTATION :
ER DSVR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
YKKZAJ Yakugaku Zasshi. Journal of Pharmacy. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) No.1- 1881- Volume(issue)/page/year: 89,1179,1969

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

  • Benzenecarbothioicacid, 4-nitro-, S-(4-bromophenyl) ester
  • Ethanethioic acid,S-(4-bromophenyl) ester
  • Benzenecarbothioicacid, S-(4-nitrophenyl) ester
  • Benzenecarbothioicacid, S-[(4,4-dimethyl-2,6-dioxocyclohexyl)methyl] ester
  • Benzenecarbothioicacid, S-[(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)methyl] ester
  • 1-[(S)-(4-bromophenyl)methylsulfinyl]propan-2-one