Dibenzoyl Thiamine
Suppliers
Names
[ CAS No. ]:
299-88-7
[ Name ]:
Dibenzoyl Thiamine
[Synonym ]:
O,S-Dibenzoyl-thiamin
Dibenzoylthiamine
Bentiaminum [INN-Latin]
O,S-Bis(benzoyl)thiamine disulfide
Bentiamine [INN]
Dibenzoylthiamin
Dibenzoyl ThiaMine
Bentiamina [INN-Spanish]
N-(4-amino-2-methyl-pyrimidin-5-ylmethyl)-N-(4-benzoyloxy-2-benzoylsulfanyl-1-methyl-but-1-enyl)-formamide
O,S-Dibenzoylthiamine
Bentiamine
Chemical & Physical Properties
[ Density]:
1.291g/cm3
[ Boiling Point ]:
718.2ºC at 760mmHg
[ Melting Point ]:
173ºC
[ Molecular Formula ]:
C26H26N4O4S
[ Molecular Weight ]:
490.57400
[ Flash Point ]:
388.1ºC
[ Exact Mass ]:
490.16700
[ PSA ]:
140.78000
[ LogP ]:
5.59490
[ Vapour Pressure ]:
1.78E-20mmHg at 25°C
[ Index of Refraction ]:
1.639
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DH6908500
- CHEMICAL NAME :
- Benzoic acid, thio-, S-ester with N-((4-amino-2-methyl-5-pyrimidinyl)methyl)-N-(4-hydro xy- 2-mercapto-1-methyl-1-butenyl)formamide benzoate (ester)
- CAS REGISTRY NUMBER :
- 299-88-7
- LAST UPDATED :
- 199806
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C26-H26-N4-O4-S
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 :
- 7480 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 62,123,1966
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2120 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NYKZAU Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. (Nippon Yakuri Gakkai, c/o Kyoto Daigaku Igakubu Yakurigaku Kyoshitsu, Konoe-cho, Yoshida, Sakyo-ku, Kyoto 606, Japan) V.40- 1944- Volume(issue)/page/year: 62,123,1966
Safety Information
[ RTECS ]:
DH6908500