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Bisbentiamine disulfide

Names

[ CAS No. ]:
2667-89-2

[ Name ]:
Bisbentiamine disulfide

[Synonym ]:
BENZOYLTHIAMINEDISULPHIDE
bis(o-benzoylthiamine)disulfide
bisbenthiamine
O-benzoylthiamine disulfide
BISBENTIAMINE DISULFIDE
beprocin
beston
Thiamindisulfid-monosulfoxid-O-benzoylester
O-Benzoylthiamindisulfid
Bisbentiamin
dibenzoate(ester)
N,N'-bis-(4-amino-2-methyl-pyrimidin-5-ylmethyl)-N,N'-[2,5-bis-(2-benzoyloxy-ethyl)-1,6-dimethyl-3,4-dithia-hexa-1,5-diene-1,6-diyl]-bis-formamide
benzoylthiaminedisulfide
btds

Chemical & Physical Properties

[ Density]:
1.331g/cm3

[ Boiling Point ]:
987.4ºC at 760mmHg

[ Melting Point ]:
140-145ºC

[ Molecular Formula ]:
C38H42N8O6S2

[ Molecular Weight ]:
770.92000

[ Flash Point ]:
551ºC

[ Exact Mass ]:
770.26700

[ PSA ]:
247.42000

[ LogP ]:
8.43760

[ Vapour Pressure ]:
0mmHg at 25°C

[ Index of Refraction ]:
1.654

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
LQ2720000
CHEMICAL NAME :
Formamide, N,N'-(dithiobis(2-(2-hydroxyethyl)-1-methylvinylene)) bis(N-((4-amino-2-met hyl- 5-pyrimidinyl)methyl)-, dibenzoate (ester)
CAS REGISTRY NUMBER :
2667-89-2
BEILSTEIN REFERENCE NO. :
0741598
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C38-H42-N8-O6-S2
MOLECULAR WEIGHT :
771.00
WISWESSER LINE NOTATION :
T6N CNJ B1 DZ E1NVHY1&UY2OVR&SSY2OVR&UY1&NVH1- ET6N CNJ B1 DZ

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 :
9 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,609,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
194 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,609,1982

Related Compounds