1H-Purine-2, 6-dione, 8-[2- (1,3-benzodioxol-5-yl)ethenyl]-3,7-dihydro-1, 3-dimethyl-

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Names

[ CAS No. ]:
73908-79-9

[ Name ]:
1H-Purine-2, 6-dione, 8-[2- (1,3-benzodioxol-5-yl)ethenyl]-3,7-dihydro-1, 3-dimethyl-

Chemical & Physical Properties

[ Molecular Formula ]:
C₁₆H₁₄N₄O₄

[ Molecular Weight ]:
326.30700

[ Exact Mass ]:
326.10200

[ PSA ]:
91.14000

[ LogP ]:
0.85940

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH6080000

CHEMICAL NAME :: Theophylline, 8-(3,4-(methylenedioxy)styryl)-

CAS REGISTRY NUMBER :: 73908-79-9

LAST UPDATED :: 197906

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H14-N4-O4

MOLECULAR WEIGHT :: 326.34

WISWESSER LINE NOTATION :: T56 BM DN FNVNVJ F1 H1 C1U1- GT56 BO DO CHJ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 56 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#06900

Related Compounds

N-(2-methoxy-5-methylphenyl)-2-(6-oxo-3-(1H-pyrazol-1-yl)pyridazin-1(6H)-yl)acetamide
N-(2-(1H-indol-3-yl)ethyl)-2-(6-oxo-3-(1H-pyrazol-1-yl)pyridazin-1(6H)-yl)acetamide
2-(6-oxo-3-(1H-pyrazol-1-yl)pyridazin-1(6H)-yl)-N-(pyrimidin-2-yl)acetamide
N-((1H-benzo[d]imidazol-2-yl)methyl)-2-(6-oxo-3-(1H-pyrazol-1-yl)pyridazin-1(6H)-yl)acetamide
N-(5-(ethylthio)-1,3,4-thiadiazol-2-yl)-2-(6-oxo-3-(1H-pyrazol-1-yl)pyridazin-1(6H)-yl)acetamide
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[6-oxo-3-(1H-pyrazol-1-yl)-1,6-dihydropyridazin-1-yl]acetamide
2-(6-oxo-3-(1H-pyrazol-1-yl)pyridazin-1(6H)-yl)-N-(4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)acetamide
N-(9H-fluoren-2-yl)-2-[6-oxo-3-(1H-pyrazol-1-yl)-1,6-dihydropyridazin-1-yl]acetamide
2-(6-oxo-3-(1H-pyrazol-1-yl)pyridazin-1(6H)-yl)-N-(4-(pyridin-3-yl)thiazol-2-yl)acetamide
2-(2-oxo-2-(4-(5-(trifluoromethyl)pyridin-2-yl)piperazin-1-yl)ethyl)-6-(1H-pyrazol-1-yl)pyridazin-3(2H)-one

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