Found 43 results

Search term: MF = 'C_{11}H_{18}N_{5}O_{12}P_{3}'
ChemSpider 2D Image | 2'-Deoxy-5'-O-{hydroxy[(hydroxy{[hydroxy(methoxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}adenosine | C11H18N5O12P3

2'-Deoxy-5'-O-{hydroxy[(hydroxy{[hydroxy(methoxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}adenosine

  • Molecular FormulaC11H18N5O12P3
  • Average mass505.208 Da
  • Monoisotopic mass505.016479 Da
  • ChemSpider ID152288

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2'-Deoxy-5'-O-{hydroxy[(hydroxy{[hydroxy(methoxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}adenosine [ACD/IUPAC Name]
2'-Desoxy-5'-O-{hydroxy[(hydroxy{[hydroxy(methoxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}adenosin [German] [ACD/IUPAC Name]
2'-Désoxy-5'-O-{hydroxy[(hydroxy{[hydroxy(méthoxy)phosphoryl]oxy}phosphoryl)oxy]phosphoryl}adénosine [French] [ACD/IUPAC Name]
Adenosine, 2'-deoxy-5'-O-[hydroxy[[hydroxy[(hydroxymethoxyphosphinyl)oxy]phosphinyl]oxy]phosphinyl]- [ACD/Index Name]
2'-Deoxyadenosine 5'-(tetrahydrogen triphosphate) monomethyl ester
87202-49-1 [RN]
Adenosine 5'-(tetrahydrogen triphosphate), 2'-deoxy-, monomethyl ester

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

Density: 2.3±0.1 g/cm3
Boiling Point: 837.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 127.6±3.0 kJ/mol
Flash Point: 460.5±37.1 °C
Index of Refraction: 1.801
Molar Refractivity: 93.9±0.5 cm3
#H bond acceptors: 17
#H bond donors: 6
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -4.35
ACD/LogD (pH 5.5): -10.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 277 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 143.6±7.0 dyne/cm
Molar Volume: 219.6±7.0 cm3

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