ChemicalBook--->CAS DataBase List--->4270-27-3

4270-27-3

4270-27-3 Structure

4270-27-3 Structure
IdentificationMore
[Name]

6-Chlorouracil
[CAS]

4270-27-3
[Synonyms]

4-CHLORO-2,6-DIHYDROXYPYRIMIDINE
4-CHLOROURACIL
6-CHLORO-2,4(1H,3H)-PYRIMIDINEDIONE
6-CHLORO-2,4-DIHYDROXYPYRIMIDINE
6-CHLOROURACIL
AURORA KA-4918
SPECS AB-323/25048125
TIMTEC-BB SBB004104
2,4(1H,3H)-Pyrimidinedione, 6-chloro-
2,4-Pyrimidinediol,6-chloro-
6-Chloro-2,4-dihydroxypyrimidine~4-Chlorouracil
2,4(1H,3H)-Pyrimidinedione, 6-chloro-(9CI)
6-Chlorouracil,98+%
4-Chloro-2,6-dihydroxypyrimidine, 6-Chloro-2,4-dihydroxypyrimidine, 6-Chlorouracil
[EINECS(EC#)]

224-258-0
[Molecular Formula]

C4H3ClN2O2
[MDL Number]

MFCD00014595
[Molecular Weight]

146.53
[MOL File]

4270-27-3.mol
Chemical PropertiesBack Directory
[Melting point ]

290-295°C
[Boiling point ]

300°C
[density ]

1.61±0.1 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

Soluble in Ammonium Hydroxide
[form ]

Solid
[pka]

6.24±0.10(Predicted)
[color ]

White
[Water Solubility ]

4.885g/L(25 ºC)
[BRN ]

120492
[InChI]

InChI=1S/C4H3ClN2O2/c5-2-1-3(8)7-4(9)6-2/h1H,(H2,6,7,8,9)
[InChIKey]

PKUFNWPSFCOSLU-UHFFFAOYSA-N
[SMILES]

C1(=O)NC(Cl)=CC(=O)N1
[CAS DataBase Reference]

4270-27-3(CAS DataBase Reference)
[NIST Chemistry Reference]

6-Chlorouracil(4270-27-3)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29335990
Hazard InformationBack Directory
[Chemical Properties]

White to off-white powder
[Uses]

6-Chlorouracil acts as an inhibitor of yeast alcohol dehydrogenase (ADH-H). 6-Chlorouracil is a potential inhibitor of DNA repair glycosylases.
[Uses]

Chlorouracil (4-Chlorouracil; 6-Chlorouracil) is a halogenated uracil that is useful in studies of the effects of halogenation on nucleic acid base-pair stability and alkali metal ion affinity. Reaction of 6-chlorouracil with 4-(dimethylamino)pyridine, 4-methylpyridine, and pyridin-4-yl-morpholine yielded pyridinium-substituted uracils as chlorides which were converted into pyridinium uracilates by deprotonation. These heterocyclic mesomeric betaines are cross-conjugated and thus possess separate cationic (pyridinium) and anionic (uracilate) moieties. Calculations and X-ray single crystal analyses may be used to characterize these systems and to compare the salts with the betaines.
Spectrum DetailBack Directory
[Spectrum Detail]

6-Chlorouracil(4270-27-3)MS
6-Chlorouracil(4270-27-3)1HNMR
6-Chlorouracil(4270-27-3)13CNMR
6-Chlorouracil(4270-27-3)IR1
6-Chlorouracil(4270-27-3)IR2
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

6-Chlorouracil, 98+%(4270-27-3)
[Sigma Aldrich]

4270-27-3(sigmaaldrich)
[TCI AMERICA]

6-Chlorouracil,>98.0%(T)(4270-27-3)
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