ChemSpider 2D Image | 4-Amino-5-chloro-1-[5-(hydroxymethyl)-2,5-dihydro-2-furanyl]-2(1H)-pyrimidinone | C9H10ClN3O3

4-Amino-5-chloro-1-[5-(hydroxymethyl)-2,5-dihydro-2-furanyl]-2(1H)-pyrimidinone

  • Molecular FormulaC9H10ClN3O3
  • Average mass243.647 Da
  • Monoisotopic mass243.041061 Da
  • ChemSpider ID28563174

More details:

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

2(1H)-Pyrimidinone, 4-amino-5-chloro-1-[2,5-dihydro-5-(hydroxymethyl)-2-furanyl]- [ACD/Index Name]
4-Amino-5-chlor-1-[5-(hydroxymethyl)-2,5-dihydro-2-furanyl]-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-5-chloro-1-[5-(hydroxymethyl)-2,5-dihydro-2-furanyl]-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-5-chloro-1-[5-(hydroxyméthyl)-2,5-dihydro-2-furanyl]-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
124743-30-2 [RN]
4-amino-5-chloro-1-[(2r,5s)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2(1h)-one

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

Density: 1.7±0.1 g/cm3
Boiling Point: 429.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 79.1±6.0 kJ/mol
Flash Point: 213.7±31.5 °C
Index of Refraction: 1.703
Molar Refractivity: 55.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.02
ACD/LogD (pH 5.5): -0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.53
ACD/LogD (pH 7.4): -0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.54
Polar Surface Area: 88 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 69.0±7.0 dyne/cm
Molar Volume: 143.2±7.0 cm3

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