ChemSpider 2D Image | 4-Amino-1-(2-O-phosphono-D-ribofuranosyl)-2(1H)-pyrimidinone | C9H14N3O8P

4-Amino-1-(2-O-phosphono-D-ribofuranosyl)-2(1H)-pyrimidinone

  • Molecular FormulaC9H14N3O8P
  • Average mass323.197 Da
  • Monoisotopic mass323.051849 Da
  • ChemSpider ID35032091

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

2(1H)-Pyrimidinone, 4-amino-1-(2-O-phosphono-D-ribofuranosyl)- [ACD/Index Name]
4-Amino-1-(2-O-phosphono-D-ribofuranosyl)-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-(2-O-phosphono-D-ribofuranosyl)-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-(2-O-phosphono-D-ribofuranosyl)-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
[(3R,4R,5R)-2-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxyphosphonic acid
{[(3R,4R,5R)-2-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid
2'-CMP
2'-Cytidylic acid [ACD/Index Name] [ACD/IUPAC Name]
85-94-9 [RN]
Cytidine 2'-monophosphate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 2.2±0.1 g/cm3
Boiling Point: 693.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 116.2±6.0 kJ/mol
Flash Point: 373.4±34.3 °C
Index of Refraction: 1.775
Molar Refractivity: 62.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -2.68
ACD/LogD (pH 5.5): -7.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 185 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 121.6±7.0 dyne/cm
Molar Volume: 150.0±7.0 cm3

Click to predict properties on the Chemicalize site


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