ChemSpider 2D Image | 9-(2-Deoxy-5-O-phosphonopentofuranosyl)-N-(7,8,9-trihydroxy-7,8,9,10-tetrahydrobenzo[pqr]tetraphen-10-yl)-9H-purin-6-amine | C30H28N5O9P

9-(2-Deoxy-5-O-phosphonopentofuranosyl)-N-(7,8,9-trihydroxy-7,8,9,10-tetrahydrobenzo[pqr]tetraphen-10-yl)-9H-purin-6-amine

  • Molecular FormulaC30H28N5O9P
  • Average mass633.545 Da
  • Monoisotopic mass633.162476 Da
  • ChemSpider ID3672481

More details:

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

9-(2-Deoxy-5-O-phosphonopentofuranosyl)-N-(7,8,9-trihydroxy-7,8,9,10-tetrahydrobenzo[pqr]tetraphen-10-yl)-9H-purin-6-amine [ACD/IUPAC Name]
9-(2-Desoxy-5-O-phosphonopentofuranosyl)-N-(7,8,9-trihydroxy-7,8,9,10-tetrahydrobenzo[pqr]tetraphen-10-yl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-(2-Désoxy-5-O-phosphonopentofuranosyl)-N-(7,8,9-trihydroxy-7,8,9,10-tétrahydrobenzo[pqr]tétraphén-10-yl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-(2-deoxy-5-O-phosphonopentofuranosyl)-N-(7,8,9,10-tetrahydro-7,8,9-trihydroxybenzo[a]pyren-10-yl)- [ACD/Index 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: 1028.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 157.4±3.0 kJ/mol
Flash Point: 575.6±37.1 °C
Index of Refraction: 1.888
Molar Refractivity: 152.2±0.5 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 2.31
ACD/LogD (pH 5.5): -1.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 222 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 97.5±7.0 dyne/cm
Molar Volume: 330.3±7.0 cm3

Click to predict properties on the Chemicalize site


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