ChemSpider 2D Image | N-Butyryl-2',3'-di-O-butyryladenosine 5'-(dihydrogen phosphate) | C22H32N5O10P

N-Butyryl-2',3'-di-O-butyryladenosine 5'-(dihydrogen phosphate)

  • Molecular FormulaC22H32N5O10P
  • Average mass557.491 Da
  • Monoisotopic mass557.188660 Da
  • ChemSpider ID9932150

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Adenosine, N-(1-oxobutyl)-, 2',3'-dibutanoate 5'-(dihydrogen phosphate) [ACD/Index Name]
N-Butyryl-2',3'-di-O-butyryladenosin5'-(dihydrogenphosphat) [German] [ACD/IUPAC Name]
N-Butyryl-2',3'-di-O-butyryladenosine 5'-(dihydrogen phosphate) [ACD/IUPAC Name]
N-Butyryl-2',3'-di-O-butyryladénosine-5'-(dihydrogène phosphate) [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.643
Molar Refractivity: 129.4±0.5 cm3
#H bond acceptors: 15
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 2.98
ACD/LogD (pH 5.5): -1.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 211 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 64.3±7.0 dyne/cm
Molar Volume: 357.7±7.0 cm3

Click to predict properties on the Chemicalize site


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