ChemicalBook--->CAS DataBase List--->56177-80-1

56177-80-1

56177-80-1 Structure

56177-80-1 Structure
IdentificationMore
[Name]

2-Ethoxy-5-fluoro-1H-pyrimidin-4-one
[CAS]

56177-80-1
[Synonyms]

2-ethoxy-5-fluoro-1h-pyrimidin-4-one
2-ETHOXY-5-FLUORO-2,3-DIHYDROPYRIMIDIN-4(1H)-ONE
2-ETHOXY-5-FLUORO-4(3H)-PYRIMIDINONE
2-ETHOXY-5-FLUORO-4-HYDROXYPYRIMIDINE
2-ETHOXY-5-FLUORO-4-PYRIMIDINONE
2-ETHOXY-5-FLUOROURACIL
5-FLUORO-2-ETHOXY-4(1H)-PYRIMIDINONE
5-FLUORO-2-ETHOXY-4-PYRIMIDINONE
ETHOXYFLUOROURACIL
2-ethoxy-5-fluoropyrimidin-4(3H)-one
2-ethoxyl-5-fluorouracil
2-ETHOXY-5-FLUOROPYRIMIDIN-4(1H)-ONE
2-Ethoxy-5-fluoro-pyrimidin-4-ol
5-EFV
2-Ethoxy-5-fluoro-4(1H)-pyrimidinone
[EINECS(EC#)]

260-029-1
[Molecular Formula]

C6H7FN2O2
[MDL Number]

MFCD03427213
[Molecular Weight]

158.13
[MOL File]

56177-80-1.mol
Chemical PropertiesBack Directory
[Melting point ]

180-184 °C (lit.)
[density ]

1.36±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

neat
[pka]

6.45±0.50(Predicted)
[Appearance]

White to off-white Solid
[Water Solubility ]

2g/L at 20℃
[InChI]

InChI=1S/C6H7FN2O2/c1-2-11-6-8-3-4(7)5(10)9-6/h3H,2H2,1H3,(H,8,9,10)
[InChIKey]

XREDGJFKPWBNRQ-UHFFFAOYSA-N
[SMILES]

C1(OCC)=NC=C(F)C(=O)N1
[LogP]

-0.96 at 25℃
[CAS DataBase Reference]

56177-80-1(CAS DataBase Reference)
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
[REACH Registrations]

Active
[HS Code ]

29335990
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Ethoxy-5-fluoro-4(3H)-pyrimidinone (Fluorouracil EP Impurity F) is a derivative of 5-fluorouracil (3C,15N2 labelled, F596002) which is a potent antineoplastic agent in clinical use.
Spectrum DetailBack Directory
[Spectrum Detail]

2-Ethoxy-5-fluoro-1H-pyrimidin-4-one(56177-80-1)MS
2-Ethoxy-5-fluoro-1H-pyrimidin-4-one(56177-80-1)1HNMR
2-Ethoxy-5-fluoro-1H-pyrimidin-4-one(56177-80-1)13CNMR
2-Ethoxy-5-fluoro-1H-pyrimidin-4-one(56177-80-1)IR1
2-Ethoxy-5-fluoro-1H-pyrimidin-4-one(56177-80-1)IR2
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

56177-80-1(sigmaaldrich)
[TCI AMERICA]

2-Ethoxy-5-fluoro-4-pyrimidinone,>98.0%(GC)(56177-80-1)
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