ChemicalBook--->CAS DataBase List--->2001-93-6

2001-93-6

2001-93-6 Structure

2001-93-6 Structure
IdentificationMore
[Name]

DITHIOURACIL
[CAS]

2001-93-6
[Synonyms]

2,4(1H,3H)-PYRIMIDINEDITHIONE
2,4-DIMERCAPTOPYRIMIDINE
2,4-DITHIOPYRIMIDINE
2,4-DITHIOURACIL
2,4-PYRIMIDINEDITHIOL
DITHIOURACIL
PYRIMIDINE-2,4-DITHIOL
2,4-dithio-uraci
2,4-Dithioxopyrimidine
Dithiopyrimidine
Uracil, 2,4-dithio-
USAF cb-14
usafcb-14
2,4(1H,3H)-Pyrimidinedithione (9CI)
1H-Pyrimidine-2,4-dithione
2,4(1H,3H)-Pyrimidinedithione, 2,4-Dimercaptopyrimidine
4-Mercapto-2(1H)-pyrimidinethione
Pyrimidine-2,4(1H,3H)-dithione
[EINECS(EC#)]

217-894-5
[Molecular Formula]

C4H4N2S2
[MDL Number]

MFCD00006042
[Molecular Weight]

144.22
[MOL File]

2001-93-6.mol
Chemical PropertiesBack Directory
[Appearance]

yellow crystalline powder
[Melting point ]

279-281 °C (dec.) (lit.)
[Boiling point ]

225.6±23.0 °C(Predicted)
[density ]

1.391 (estimate)
[refractive index ]

1.5000 (estimate)
[storage temp. ]

Store Cold
[form ]

solid
[pka]

6.55±0.20(Predicted)
[InChI]

1S/C4H4N2S2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)
[InChIKey]

ZEQIWKHCJWRNTH-UHFFFAOYSA-N
[SMILES]

S=C1NC=CC(=S)N1
[CAS DataBase Reference]

2001-93-6(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[RTECS ]

YR0175000
[HS Code ]

29335990
[Storage Class]

11 - Combustible Solids
[Toxicity]

mouse,LD50,intraperitoneal,250mg/kg (250mg/kg),National Technical Information Service. Vol. AD277-689,
Raw materials And Preparation ProductsBack Directory
[Raw materials]

2-Chloro-4-methoxypyrimidine-->2-Thiouracil-->2,4-Dichloropyrimidine-->Carbamimidothioic acid-->Decahydronaphthalene-->Uracil
[Preparation Products]

2-Mercaptopyrimidin-4-ol-->4-Amino-2-mercaptopyrimidine-->2,4-Bis(methylthio)pyrimidine
Hazard InformationBack Directory
[Chemical Properties]

yellow crystalline powder
[Uses]

Dithiouracil is a potential anticancer drug and its redox mechanism and electronic absorption behavior has been investigated in a wide pH range by UV-Vis spectroscopy, cyclic voltammetry and differential pulse voltammetry.
[General Description]

Dithiouracil is a potential anticancer drug and its redox mechanism and electronic absorption behavior has been investigated in a wide pH range by UV-Vis spectroscopy, cyclic voltammetry and differential pulse voltammetry.
Spectrum DetailBack Directory
[Spectrum Detail]

DITHIOURACIL(2001-93-6)MS
DITHIOURACIL(2001-93-6)1HNMR
DITHIOURACIL(2001-93-6)IR1
DITHIOURACIL(2001-93-6)IR2
DITHIOURACIL(2001-93-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Dithiouracil, 95%(2001-93-6)
[Sigma Aldrich]

2001-93-6(sigmaaldrich)
[TCI AMERICA]

2,4-Dithiopyrimidine,>97.0%(T)(2001-93-6)
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