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155-12-4

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Basic Information
CAS No.: 155-12-4
Name: 2-CHLORO-5-FLUOROPYRIMIDIN-4-ONE
Article Data: 12
Molecular Structure:
Molecular Structure of 155-12-4 (2-CHLORO-5-FLUOROPYRIMIDIN-4-ONE)
Formula: C4H2ClFN2O
Molecular Weight: 148.524
Synonyms: NSC 80850;4-Pyrimidinol, 2-chloro-5-fluoro- (7CI,8CI);4(1H)-Pyrimidinone,2-chloro-5-fluoro- (9CI);2-Chloro-5-fluoropyrimidin-4-one;
Density: 1.706 g/cm3
Melting Point: 176-177 °C(Solv: ethanol (64-17-5))
Boiling Point: 178.5 °C at 760 mmHg
Flash Point: 61.8 °C
PSA: 46.01000
LogP: 0.97470
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    Min.Order: 1 Gram

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    155-12-4

    2-Chloro-4-hydroxy-5-fluoropyrimidine 155-12-4

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  • Casno:

    155-12-4

    2-CHLORO-5-FLUOROPYRIMIDIN-4-ONE

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  • Casno:

    155-12-4

    2-Chloro-5-fluoropyrimidin-4-one

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Chemistry

Product Name: 2-Chloro-4-hydroxy-5-fluoropyrimidine (CAS NO.155-12-4)

Molecular Formula: C4H2ClFN2O
Molecular Weight: 148.52g/mol
Mol File: 155-12-4.mol
Boiling point: 178.5 °C at 760 mmHg
Flash Point: 61.8 °C
Density: 1.7 g/cm3
Surface Tension: 47.1 dyne/cm
Enthalpy of Vaporization: 41.48 kJ/mol
Vapour Pressure: 0.985 mmHg at 25°C
XLogP3-AA: 0.6
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of 2-Chloro-4-hydroxy-5-fluoropyrimidine (CAS NO.155-12-4):
  IUPAC Name: 2-chloro-5-fluoro-1H-pyrimidin-6-one
  Canonical SMILES: C1=C(C(=O)NC(=N1)Cl)F
  InChI: InChI=1S/C4H2ClFN2O/c5-4-7-1-2(6)3(9)8-4/h1H,(H,7,8,9) 
  InChIKey: FHTLMXYURUPWJB-UHFFFAOYSA-N
Product Categories: PYRIMIDINE