ChemSpider 2D Image | 4-Amino-1-(alpha-L-threo-pentofuranosyl)-2(1H)-pyrimidinone | C9H13N3O5

4-Amino-1-(α-L-threo-pentofuranosyl)-2(1H)-pyrimidinone

  • Molecular FormulaC9H13N3O5
  • Average mass243.217 Da
  • Monoisotopic mass243.085526 Da
  • ChemSpider ID23158719

  • 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-α-L-threo-pentofuranosyl- [ACD/Index Name]
4-Amino-1-(α-L-threo-pentofuranosyl)-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-(α-L-threo-pentofuranosyl)-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-(α-L-thréo-pentofuranosyl)-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
4-Amino-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidin-2-one
4-amino-1-[(2R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
65-46-3 [RN]
d-cytidine
MFCD00006545 [MDL number]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 545.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.8±6.0 kJ/mol
Flash Point: 283.8±32.9 °C
Index of Refraction: 1.756
Molar Refractivity: 52.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.93
ACD/LogD (pH 5.5): -2.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.50
ACD/LogD (pH 7.4): -2.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.54
Polar Surface Area: 129 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 89.6±7.0 dyne/cm
Molar Volume: 128.4±7.0 cm3

Click to predict properties on the Chemicalize site


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