2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-dihydroxy-

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Names

[ CAS No. ]:
3237-50-1

[ Name ]:
2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-dihydroxy-

[Synonym ]:
5,5-Dihydroxyperhydropyrimidinetrione
EINECS 221-796-8
alloxane hydrate
Alloxan hydrate
Barbituric acid,5,5-dihydroxy
alloxan monohydrate
5,5-dihydroxy-pyrimidine-2,4,6-trione

Chemical & Physical Properties

[ Density]:
1.99g/cm3

[ Molecular Formula ]:
C4H4N2O5

[ Molecular Weight ]:
160.08500

[ Exact Mass ]:
160.01200

[ PSA ]:
115.73000

[ Index of Refraction ]:
1.63

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CQ4004800
CHEMICAL NAME :
Barbituric acid, 5,5-dihydroxy-
CAS REGISTRY NUMBER :
3237-50-1
BEILSTEIN REFERENCE NO. :
0155548
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C4-H4-N2-O5
MOLECULAR WEIGHT :
160.10

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD - Lethal dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intravenous
DOSE :
40 mg/kg
SEX/DURATION :
female 1 week(s) pre-mating
TOXIC EFFECTS :
Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated) Reproductive - Fertility - litter size (e.g. # fetuses per litter; measured before birth) Reproductive - Effects on Newborn - biochemical and metabolic

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
2490 mg/L
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 13,60,1989

Safety Information

[ HS Code ]:
2933540000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Barbituric acid
  • 5-Bromouracil
  • Uracil
  • Uric Acid
  • Chlorine
  • acetic acid

DownStream

  • Alloxazine;Isoalloxazine
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diphenyl-
  • N-carbamoyl-2,2-diphenyl-acetamide
  • 2-amino-4,6-dioxo-4a,5-dihydropteridine-7-carboxylic acid
  • 2-amino-4,7-dioxo-1,8-dihydropteridine-6-carboxylic acid
  • [5,5'-Bipyrimidine]-2,2',4,4',6,6'(1H,1'H,3H,3'H,5H,5'H)-hexone,5,5'-dihydroxy-
  • Benzo[g]pteridine-2,4(1H,3H)-dione, 10-(2-hydroxyethyl)-
  • LUMICHROME
  • 5-hydroxy-5-(2-hydroxy-6-oxo-1-cyclohexenyl)-1,3-diazinane-2,4,6-trione
  • Hydrazinecarbothioamide,2-(tetrahydro-2,4,6-trioxo-5(2H)-pyrimidinylidene)-

Customs

[ HS Code ]: 2933540000

[ Summary ]:
2933540000 other derivatives of malonylurea (barbituric acid); salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:20.0%

Related Compounds

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diethyl-1-phenyl-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(5-methoxy-1H-indol-3-yl)methyl]-1,3-dimethyl
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(5-methoxy-1H-indol-3-yl)methylene]-1,3-dimethyl
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diphenyl-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-[[5-(diethylamino)-2-furanyl]methylene]-1-(3-fluorophenyl)-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione,5,5-diethyl-1-(1-piperidinylmethyl)-
  • 1-({[(Prop-2-en-1-yloxy)carbonyl]amino}methyl)spiro[2.3]hexane-1-carboxylic acid
  • rac-(1R,3S)-3-{[(prop-2-en-1-yloxy)carbonyl]amino}spiro[3.3]heptane-1-carboxylic acid
  • 2-[(Prop-2-en-1-yloxy)carbonyl]-decahydroisoquinoline-1-carboxylic acid
  • 8-[(Prop-2-en-1-yloxy)carbonyl]-8-azaspiro[4.5]decane-7-carboxylic acid
  • rac-(3R,4S)-3,4-dimethoxy-1-[(prop-2-en-1-yloxy)carbonyl]piperidine-4-carboxylic acid
  • 2-{[(Prop-2-en-1-yloxy)carbonyl]amino}-1,3-benzothiazole-7-carboxylic acid
  • 4-{[(Prop-2-en-1-yloxy)carbonyl][(pyridin-2-yl)methyl]amino}butanoic acid
  • 1-[(tert-butoxy)carbonyl]-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
  • 2,3-Difluoro-5-{[(prop-2-en-1-yloxy)carbonyl]amino}benzoic acid
  • rac-(4aR,7aS)-4-[(prop-2-en-1-yloxy)carbonyl]-hexahydro-2H-furo[3,4-b][1,4]oxazine-2-carboxylic acid
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