ChemSpider 2D Image | 3-[(4aR,6S,7S,7aS)-2,7-Dihydroxy-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-imino-3,6-dihydro-2(1H)-pyridinone | C10H13N2O7P

3-[(4aR,6S,7S,7aS)-2,7-Dihydroxy-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-imino-3,6-dihydro-2(1H)-pyridinone

  • Molecular FormulaC10H13N2O7P
  • Average mass304.193 Da
  • Monoisotopic mass304.046051 Da
  • ChemSpider ID95600656

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

2(1H)-Pyridinone, 3,6-dihydro-6-imino-3-[(4aR,6S,7S,7aS)-tetrahydro-2,7-dihydroxy-2-oxido-4H-furo[3,2-d]-1,3,2-dioxaphosphorin-6-yl]- [ACD/Index Name]
3-[(4aR,6S,7S,7aS)-2,7-Dihydroxy-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-imino-3,6-dihydro-2(1H)-pyridinon [German] [ACD/IUPAC Name]
3-[(4aR,6S,7S,7aS)-2,7-Dihydroxy-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-imino-3,6-dihydro-2(1H)-pyridinone [ACD/IUPAC Name]
3-[(4aR,6S,7S,7aS)-2,7-Dihydroxy-2-oxydotétrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-imino-3,6-dihydro-2(1H)-pyridinone [French] [ACD/IUPAC Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.820
Molar Refractivity: 60.4±0.5 cm3
#H bond acceptors: 9
#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: 148 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 116.4±7.0 dyne/cm
Molar Volume: 138.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement