ChemSpider 2D Image | Methyl 2-amino-6-chloro-9H-purine-9-acetate | C8H8ClN5O2

Methyl 2-amino-6-chloro-9H-purine-9-acetate

  • Molecular FormulaC8H8ClN5O2
  • Average mass241.634 Da
  • Monoisotopic mass241.036652 Da
  • ChemSpider ID57605372

More details:

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

(2-Amino-6-chloro-9H-purin-9-yl)acétate de méthyle [French] [ACD/IUPAC Name]
172405-46-8 [RN]
9H-Purine-9-acetic acid, 2-amino-6-chloro-, methyl ester [ACD/Index Name]
Methyl (2-amino-6-chloro-9H-purin-9-yl)acetate [ACD/IUPAC Name]
Methyl 2-amino-6-chloro-9H-purine-9-acetate
Methyl-(2-amino-6-chlor-9H-purin-9-yl)acetat [German] [ACD/IUPAC Name]
methyl 2-(2-amino-6-chloro-9H-purin-9-yl)acetate

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

Density: 1.7±0.1 g/cm3
Boiling Point: 500.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 256.3±32.9 °C
Index of Refraction: 1.744
Molar Refractivity: 56.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.26
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.48
ACD/KOC (pH 5.5): 46.12
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.48
ACD/KOC (pH 7.4): 46.12
Polar Surface Area: 96 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 70.2±7.0 dyne/cm
Molar Volume: 138.3±7.0 cm3

Click to predict properties on the Chemicalize site


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