Found 1 result

Search term: N[C@@H]1[C@@H](COP(O)(O)=O)O[C@H]([C@@H]1O)n1cnc2c(N)ncnc12 (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 3'-Amino-3'-deoxyadenosine 5'-(dihydrogen phosphate) | C10H15N6O6P

3'-Amino-3'-deoxyadenosine 5'-(dihydrogen phosphate)

  • Molecular FormulaC10H15N6O6P
  • Average mass346.237 Da
  • Monoisotopic mass346.079071 Da
  • ChemSpider ID25057616

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

3'-Amino-3'-deoxyadenosine 5'-(dihydrogen phosphate) [ACD/IUPAC Name]
3'-Amino-3'-desoxyadenosin5'-(dihydrogenphosphat) [German] [ACD/IUPAC Name]
3'-Amino-3'-désoxyadénosine-5'-(dihydrogène phosphate) [French] [ACD/IUPAC Name]
Adenosine, 3'-amino-3'-deoxy-, 5'-(dihydrogen phosphate) [ACD/Index Name]
4360-05-8 [RN]

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

Density: 2.3±0.1 g/cm3
Boiling Point: 780.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.1±3.0 kJ/mol
Flash Point: 425.8±35.7 °C
Index of Refraction: 1.930
Molar Refractivity: 71.0±0.5 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.17
ACD/LogD (pH 5.5): -5.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 144.5±7.0 dyne/cm
Molar Volume: 149.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement