ChemSpider 2D Image | 6-[3-Hydroxy-2-(hydroxymethyl)-1-propen-1-yl]-4-methoxy-1,5-dimethyl-2(1H)-pyrimidinone | C11H16N2O4

6-[3-Hydroxy-2-(hydroxymethyl)-1-propen-1-yl]-4-methoxy-1,5-dimethyl-2(1H)-pyrimidinone

  • Molecular FormulaC11H16N2O4
  • Average mass240.256 Da
  • Monoisotopic mass240.111008 Da
  • ChemSpider ID35033855

More details:






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

2(1H)-Pyrimidinone, 6-[3-hydroxy-2-(hydroxymethyl)-1-propen-1-yl]-4-methoxy-1,5-dimethyl- [ACD/Index Name]
6-[3-Hydroxy-2-(hydroxymethyl)-1-propen-1-yl]-4-methoxy-1,5-dimethyl-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
6-[3-Hydroxy-2-(hydroxymethyl)-1-propen-1-yl]-4-methoxy-1,5-dimethyl-2(1H)-pyrimidinone [ACD/IUPAC Name]
6-[3-Hydroxy-2-(hydroxyméthyl)-1-propén-1-yl]-4-méthoxy-1,5-diméthyl-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
6-[3-Hydroxy-2-(Hydroxymethyl)prop-1-En-1-Yl]-4-Methoxy-1,5-Dimethylpyrimidin-2(1h)-One
I43

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 433.3±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 79.6±6.0 kJ/mol
Flash Point: 215.8±29.6 °C
Index of Refraction: 1.548
Molar Refractivity: 61.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.66
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.05
ACD/LogD (pH 7.4): -0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.06
Polar Surface Area: 82 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 42.6±7.0 dyne/cm
Molar Volume: 192.5±7.0 cm3

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