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Search term: NCVPVIXUXLDAHI (Found by InChIKey (skeleton match))

ChemSpider 2D Image | ({2-[6-(Methylamino)-9H-purin-9-yl]ethoxy}methyl)phosphonic acid | C9H14N5O4P

({2-[6-(Methylamino)-9H-purin-9-yl]ethoxy}methyl)phosphonic acid

  • Molecular FormulaC9H14N5O4P
  • Average mass287.212 Da
  • Monoisotopic mass287.078339 Da
  • ChemSpider ID28552607

More details:






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

({2-[6-(Methylamino)-9H-purin-9-yl]ethoxy}methyl)phosphonic acid [ACD/IUPAC Name]
({2-[6-(Methylamino)-9H-purin-9-yl]ethoxy}methyl)phosphonsäure [German] [ACD/IUPAC Name]
Acide ({2-[6-(méthylamino)-9H-purin-9-yl]éthoxy}méthyl)phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [[2-[6-(methylamino)-9H-purin-9-yl]ethoxy]methyl]- [ACD/Index Name]
653584-15-7 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 611.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 323.5±34.3 °C
Index of Refraction: 1.710
Molar Refractivity: 65.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.53
ACD/LogD (pH 5.5): -3.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 82.3±7.0 dyne/cm
Molar Volume: 168.1±7.0 cm3

Click to predict properties on the Chemicalize site






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