ChemSpider 2D Image | (4aR,6R,7R,7aS)-6-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-7-hydroxytetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide | C9H11N3O7P

(4aR,6R,7R,7aS)-6-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-7-hydroxytetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide

  • Molecular FormulaC9H11N3O7P
  • Average mass304.174 Da
  • Monoisotopic mass304.033997 Da
  • ChemSpider ID26331001

  • Charge - Charge

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(4aR,6R,7R,7aS) 2-Oxyde de 6-(4-amino-2-oxo-1(2H)-pyrimidinyl)-7-hydroxytétrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate [French] [ACD/IUPAC Name]
(4aR,6R,7R,7aS)-6-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-7-hydroxytetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olat-2-oxid [German] [ACD/IUPAC Name]
(4aR,6R,7R,7aS)-6-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-7-hydroxytetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide [ACD/IUPAC Name]
2(1H)-Pyrimidinone, 4-amino-1-[(4aR,6R,7R,7aS)-tetrahydro-2,7-dihydroxy-2-oxido-4H-furo[3,2-d]-1,3,2-dioxaphosphorin-6-yl]-, ion(1-) [ACD/Index Name]
3',5'-cyclic CMP
3',5'-cyclic CMP anion
3',5'-cyclic CMP(1-)
cytidine 3',5'-phosphate
cytidine 3',5'-phosphate(1-)

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

Density:
Boiling Point: 580.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 99.7±6.0 kJ/mol
Flash Point: 305.0±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 157 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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