ChemSpider 2D Image | 2-Amino-8-chloro-1H-purin-6(7H)-one | C5H4ClN5O

2-Amino-8-chloro-1H-purin-6(7H)-one

  • Molecular FormulaC5H4ClN5O
  • Average mass185.571 Da
  • Monoisotopic mass185.010437 Da
  • ChemSpider ID28536283

More details:

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

22052-03-5 [RN]
2-Amino-8-chlor-1,2-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-8-chloro-1,2-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-8-chloro-1,2-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
2-Amino-8-chloro-1H-purin-6(7H)-one
6H-Purin-6-one, 2-amino-8-chloro-1,2-dihydro- [ACD/Index Name]
1822984-67-7 [RN]
MFCD00672144 [MDL number]
MFCD23135273

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

Density: 2.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 2.038
Molar Refractivity: 40.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.73
ACD/LogD (pH 5.5): -1.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.26
ACD/LogD (pH 7.4): -2.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 119.5±7.0 dyne/cm
Molar Volume: 78.2±7.0 cm3

Click to predict properties on the Chemicalize site


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