hexobendine

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Names

[ CAS No. ]:
54-03-5

[ Name ]:
hexobendine

[Synonym ]:
Hexabendin
Hexabendine
Hexobendin

Chemical & Physical Properties

[ Density]:
1.147g/cm3

[ Boiling Point ]:
623.3ºC at 760mmHg

[ Molecular Formula ]:
C30H44N2O10

[ Molecular Weight ]:
592.67800

[ Flash Point ]:
330.8ºC

[ Exact Mass ]:
592.30000

[ PSA ]:
114.46000

[ LogP ]:
3.39580

[ Index of Refraction ]:
1.525

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DI0220000
CHEMICAL NAME :
Benzoic acid, 3,4,5-trimethoxy-, diester with 3,3'-(ethylenebis(methylimino))di-1-propanol
CAS REGISTRY NUMBER :
54-03-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C30-H44-N2-O10
MOLECULAR WEIGHT :
592.76
WISWESSER LINE NOTATION :
1OR BO1 CO1 EVO3N1&2N1&3OVR CO1 DO1 EO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
34 mg/kg
TOXIC EFFECTS :
Behavioral - tremor Behavioral - convulsions or effect on seizure threshold Behavioral - ataxia
REFERENCE :
PJPPAA Polish Journal of Pharmacology and Pharmacy. (ARS Polona, POB 1001, 00-068 Warsaw 1, Poland) V.25- 1973- Volume(issue)/page/year: 32,823,1980

Related Compounds

  • Hexobendine dihydrochloride
  • 4-(Difluoromethyl)-5-iodo-2-methyl-3-nitropyridine
  • 4,5-Dichloro-2-fluorophenylacetonitrile
  • 4-(Difluoromethyl)-5-hydroxypyridine-3-sulfonamide
  • 4-(Difluoromethyl)-5-iodo-6-methylpyridine-2-sulfonamide
  • 4-(Aminomethyl)-6-(difluoromethyl)-5-(trifluoromethoxy)pyridine-2-sulfonyl chloride
  • (2-(Difluoromethyl)-3-iodo-5-methoxypyridin-4-yl)methanamine
  • 4-(Difluoromethyl)-5-methoxy-2-(trifluoromethoxy)nicotinic acid
  • 4,5-Dichloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
  • (4-Chloro-3-(difluoromethoxy)phenyl)(pyridin-4-yl)methanone
  • 4-(Difluoromethyl)-6-hydroxy-2-(trifluoromethoxy)nicotinic acid
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