1H-Imidazo[4,5-d]pyridazine-4,7-dione,2,3,5,6-tetrahydro-1-phenyl-2-thioxo-

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Names

[ CAS No. ]:
63886-80-6

[ Name ]:
1H-Imidazo[4,5-d]pyridazine-4,7-dione,2,3,5,6-tetrahydro-1-phenyl-2-thioxo-

[Synonym ]:
1-Phenyl-2-mercapto-4,3,5,6-tetraazaindene

Chemical & Physical Properties

[ Density]:
1.7g/cm3

[ Boiling Point ]:
425.9ºC at 760mmHg

[ Molecular Formula ]:
C11H8N4O2S

[ Molecular Weight ]:
260.27200

[ Flash Point ]:
211.4ºC

[ Exact Mass ]:
260.03700

[ PSA ]:
118.53000

[ LogP ]:
1.06470

[ Index of Refraction ]:
1.807

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NJ5101500
CHEMICAL NAME :
1H-Imidazo(4,5-d)pyridazine-4,7-dione, 2,3,5,6-tetrahydro-1-phenyl-2-thioxo-
CAS REGISTRY NUMBER :
63886-80-6
BEILSTEIN REFERENCE NO. :
0263310
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H8-N4-O2-S

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490

Related Compounds

  • (E)-N-(2-(phenylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)-2-(p-tolyl)ethenesulfonamide
  • N-(2-(propylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)-4-(trifluoromethoxy)benzamide
  • methyl 4-(N-(2-(propylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)sulfamoyl)benzoate
  • N-(2-(propylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)-1-(4-(trifluoromethyl)phenyl)methanesulfonamide
  • 1-(2-Phenoxyethyl)-3-(2-(propylsulfonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl)urea
  • 2-((4-oxo-3-(2-(thiophen-2-yl)ethyl)-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(thiazol-2-yl)acetamide
  • N-(2-(thiophen-3-yl)ethyl)-4-(trifluoromethoxy)benzamide
  • 3-(2,5-dimethoxyphenyl)-1-methyl-N-(2-(thiophen-3-yl)ethyl)-1H-pyrazole-5-carboxamide
  • N-(2-(thiophen-3-yl)ethyl)-1-(4-(trifluoromethyl)phenyl)methanesulfonamide
  • tert-Butyl 2-(((1H-benzo[d]imidazol-2-yl)sulfinyl)methyl)piperidine-1-carboxylate
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