ChemSpider 2D Image | 4-Amino-1-(5-chloro-5-deoxypentofuranosyl)-2(1H)-pyrimidinone | C9H12ClN3O4

4-Amino-1-(5-chloro-5-deoxypentofuranosyl)-2(1H)-pyrimidinone

  • Molecular FormulaC9H12ClN3O4
  • Average mass261.662 Da
  • Monoisotopic mass261.051636 Da
  • ChemSpider ID21218816

More details:

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

2(1H)-Pyrimidinone, 4-amino-1-(5-chloro-5-deoxypentofuranosyl)- [ACD/Index Name]
4-Amino-1-(5-chlor-5-desoxypentofuranosyl)-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-(5-chloro-5-deoxypentofuranosyl)-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-(5-chloro-5-désoxypentofuranosyl)-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 521.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 91.5±6.0 kJ/mol
Flash Point: 269.3±32.9 °C
Index of Refraction: 1.736
Molar Refractivity: 56.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.05
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.53
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.72
Polar Surface Area: 108 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 78.7±7.0 dyne/cm
Molar Volume: 140.5±7.0 cm3

Click to predict properties on the Chemicalize site


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