alpha;-(TETRAHYDRO-4,6-DIOXO-2-THIOXO-5(2H)PYRIMIDINYLIDENE)-o-TOLUIC ACID

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Names

[ CAS No. ]:
73909-20-3

[ Name ]:
alpha;-(TETRAHYDRO-4,6-DIOXO-2-THIOXO-5(2H)PYRIMIDINYLIDENE)-o-TOLUIC ACID

[Synonym ]:
Benzoic acid,2-((tetrahydro-4,6-dioxo-2-thioxo-5(2H)-pyrimidinylidene)methyl)
2-(4,6-dioxo-2-thioxo-tetrahydro-pyrimidin-5-ylidenemethyl)-benzoic acid

Chemical & Physical Properties

[ Density]:
1.6g/cm3

[ Molecular Formula ]:
C12H8N2O4S

[ Molecular Weight ]:
276.26800

[ Exact Mass ]:
276.02000

[ PSA ]:
127.59000

[ LogP ]:
0.95670

[ Index of Refraction ]:
1.728

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XU2220000
CHEMICAL NAME :
o-Toluic acid, alpha-(tetrahydro-4,6-dioxo-2-thioxo-5(2H)pyrimidinyl idene)-
CAS REGISTRY NUMBER :
73909-20-3
BEILSTEIN REFERENCE NO. :
0923592
LAST UPDATED :
199806
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H8-N2-O4-S

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 :
180 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#04342

Related Compounds

  • 2-(Pyridin-3-yl)cyclohexane-1-carboxylic acid
  • 5-(3-Aminopyrrolidin-1-yl)-4-chloro-2,3-dihydropyridazin-3-one
  • a-Naphthyl difluoromethyl carbinol
  • 3',5'-Bis(trifluoromethyl)-2-hydroxyacetophenone
  • 1-(1,3-Dioxaindan-5-yl)-2,2-difluoroethan-1-ol
  • (S)-3-Amino-3-(3-chloro-4-fluorophenyl)propanoic acid
  • (3R)-3-amino-3-(3-bromothiophen-2-yl)propanoic acid
  • 4-Cyclopropyl-5-(2,2-dimethylpropyl)-4H-1,2,4-triazole-3-thiol
  • 1-Chloro-3-[4-(trifluoromethyl)phenyl]propan-2-one
  • 1-(2,3-Dimethoxyphenyl)-2,2-difluoroethan-1-ol
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