ChemSpider 2D Image | 2-Amino-9-{8-[6-amino(8-~3~H)-9H-purin-9-yl]-3,9,12,18-tetrahydroxy-3,12-dioxido-2,4,7,11,13,16-hexaoxa-3,12-diphosphatricyclo[13.2.1.0~6,10~]octadec-17-yl}(8-~3~H)-1,9-dihydro-6H-purin-6-one | C20H22T2N10O13P2

2-Amino-9-{8-[6-amino(8-3H)-9H-purin-9-yl]-3,9,12,18-tetrahydroxy-3,12-dioxido-2,4,7,11,13,16-hexaoxa-3,12-diphosphatricyclo[13.2.1.06,10]octadec-17-yl}(8-3H)-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC20H22T2N10O13P2
  • Average mass678.427 Da
  • Monoisotopic mass678.116394 Da
  • ChemSpider ID114396808

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Amino-9-{8-[6-amino(8-3H)-9H-purin-9-yl]-3,9,12,18-tetrahydroxy-3,12-dioxido-2,4,7,11,13,16-hexaoxa-3,12-diphosphatricyclo[13.2.1.06,10]octadec-17-yl}(8-3H)-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-{8-[6-amino(8-3H)-9H-purin-9-yl]-3,9,12,18-tetrahydroxy-3,12-dioxido-2,4,7,11,13,16-hexaoxa-3,12-diphosphatricyclo[13.2.1.06,10]octadec-17-yl}(8-3H)-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-{8-[6-amino(8-3H)-9H-purin-9-yl]-3,9,12,18-tétrahydroxy-3,12-dioxydo-2,4,7,11,13,16-hexaoxa-3,12-diphosphatricyclo[13.2.1.06,10]octadéc-17-yl}(8-3H)-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one-8-t, 2-amino-9-[14-(6-amino-9H-purin-9-yl-8-t)octahydro-2,10,15,16-tetrahydroxy-2,10-dioxido-5,8-methano-12H-furo[3,2-l]-1,3,6,9,11,2,10-pentaoxadiphosphacyclotetradecin-7-yl]-1,9-dihyd ro- [ACD/Index Name]

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

Density:
Boiling Point:
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Enthalpy of Vaporization:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 23
#H bond donors: 9
#Freely Rotating Bonds: 2
#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: 345 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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