Benzenecarbothioicacid, S-(phenylmethyl) ester
Names
[ CAS No. ]:
13402-51-2
[ Name ]:
Benzenecarbothioicacid, S-(phenylmethyl) ester
[Synonym ]:
Tibenzate
S-Benzyl benzothioate
benzyl benzothioate
Tibenzatum [INN-Latin]
Benzyl thiobenzoate
Tibenzato [INN-Spanish]
S-Benzyl thiobenzoate
thiobenzoic acid S-benzyl ester
(S)-benzyl benzenecarbothioate
Chemical & Physical Properties
[ Density]:
1.167g/cm3
[ Boiling Point ]:
341ºC at 760mmHg
[ Molecular Formula ]:
C14H12OS
[ Molecular Weight ]:
228.30900
[ Flash Point ]:
146.5ºC
[ Exact Mass ]:
228.06100
[ PSA ]:
42.37000
[ LogP ]:
3.76020
[ Vapour Pressure ]:
8.26E-05mmHg at 25°C
[ Index of Refraction ]:
1.62
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DH6850000
- CHEMICAL NAME :
- Benzoic acid, thio-, S-benzyl ester
- CAS REGISTRY NUMBER :
- 13402-51-2
- BEILSTEIN REFERENCE NO. :
- 2049281
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C14-H12-O-S
- MOLECULAR WEIGHT :
- 228.32
- WISWESSER LINE NOTATION :
- RVS1R
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 :
- 1550 mg/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
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 180 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#02522
Safety Information
[ HS Code ]:
2930909090
Precursor & DownStream
Precursor
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%