ChemSpider 2D Image | Methyl difluoro(5-pyrimidinyl)acetate | C7H6F2N2O2

Methyl difluoro(5-pyrimidinyl)acetate

  • Molecular FormulaC7H6F2N2O2
  • Average mass188.132 Da
  • Monoisotopic mass188.039734 Da
  • ChemSpider ID34209703

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1803581-68-1 [RN]
5-Pyrimidineacetic acid, α,α-difluoro-, methyl ester [ACD/Index Name]
Difluoro(5-pyrimidinyl)acétate de méthyle [French] [ACD/IUPAC Name]
methyl 2,2-difluoro-2-(pyrimidin-5-yl)acetate
Methyl difluoro(5-pyrimidinyl)acetate [ACD/IUPAC Name]
Methyl-difluor(5-pyrimidinyl)acetat [German] [ACD/IUPAC Name]
MFCD28139600

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 248.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.6±3.0 kJ/mol
Flash Point: 104.1±25.9 °C
Index of Refraction: 1.458
Molar Refractivity: 38.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.02
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.24
ACD/KOC (pH 5.5): 40.67
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.24
ACD/KOC (pH 7.4): 40.68
Polar Surface Area: 52 Å2
Polarizability: 15.2±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 140.4±3.0 cm3

Click to predict properties on the Chemicalize site


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