ChemSpider 2D Image | 8-Amino-N1-Cyclic Inosine 5'-Diphosphoribose | C15H21N5O14P2

8-Amino-N1-Cyclic Inosine 5'-Diphosphoribose

  • Molecular FormulaC15H21N5O14P2
  • Average mass557.300 Da
  • Monoisotopic mass557.056030 Da
  • ChemSpider ID9483688

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(2R,3R,4S,5R,13R,14S,15R,16R) 8,10-Dioxyde de 18-amino-3,4,8,10,14,15-hexahydroxy-7,9,11,25,26-pentaoxa-1,17,19,22-tétraaza-8,10-diphosphapentacyclo[18.3.1.12,5.113,16.017,21]hexacosa-18,20,22-t rién-24-one [French] [ACD/IUPAC Name]
(2R,3R,4S,5R,13R,14S,15R,16R)-18-Amino-3,4,8,10,14,15-hexahydroxy-7,9,11,25,26-pentaoxa-1,17,19,22-tetraaza-8,10-diphosphapentacyclo[18.3.1.12,5.113,16.017,21]hexacosa-18,20,22-trien-24-on-8,10-
 dioxid [German] [ACD/IUPAC Name]
(2R,3R,4S,5R,13R,14S,15R,16R)-18-Amino-3,4,8,10,14,15-hexahydroxy-7,9,11,25,26-pentaoxa-1,17,19,22-tetraaza-8,10-diphosphapentacyclo[18.3.1.12,5.113,16.017,21]hexacosa-18,20,22-trien-24-one 8,10
 -dioxide [ACD/IUPAC Name]
8-Amino-N1-Cyclic Inosine 5'-Diphosphoribose
C8R

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

Density: 2.7±0.1 g/cm3
Boiling Point: 990.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 151.2±3.0 kJ/mol
Flash Point: 552.6±37.1 °C
Index of Refraction: 1.990
Molar Refractivity: 103.2±0.5 cm3
#H bond acceptors: 19
#H bond donors: 8
#Freely Rotating Bonds: 0
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 298 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 184.9±7.0 dyne/cm
Molar Volume: 207.7±7.0 cm3

Click to predict properties on the Chemicalize site


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