ChemSpider 2D Image | {(2Z)-2-[(2-Amino-9H-purin-9-yl)methylene]-1,1-cyclopropanediyl}dimethanol | C11H13N5O2

{(2Z)-2-[(2-Amino-9H-purin-9-yl)methylene]-1,1-cyclopropanediyl}dimethanol

  • Molecular FormulaC11H13N5O2
  • Average mass247.253 Da
  • Monoisotopic mass247.106918 Da
  • ChemSpider ID28502216

  • Double-bond stereo - Double-bond stereo

More details:

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

{(2Z)-2-[(2-Amino-9H-purin-9-yl)methylen]-1,1-cyclopropandiyl}dimethanol [German] [ACD/IUPAC Name]
{(2Z)-2-[(2-Amino-9H-purin-9-yl)methylene]-1,1-cyclopropanediyl}dimethanol [ACD/IUPAC Name]
{(2Z)-2-[(2-Amino-9H-purin-9-yl)méthylène]-1,1-cyclopropanediyl}diméthanol [French] [ACD/IUPAC Name]
1,1-Cyclopropanedimethanol, 2-[(2-amino-9H-purin-9-yl)methylene]-, (2Z)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 603.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.4±3.0 kJ/mol
Flash Point: 318.9±34.3 °C
Index of Refraction: 1.809
Molar Refractivity: 62.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.31
ACD/LogD (pH 5.5): -0.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.31
ACD/LogD (pH 7.4): -0.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.66
Polar Surface Area: 110 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 84.0±7.0 dyne/cm
Molar Volume: 145.8±7.0 cm3

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