ChemSpider 2D Image | [6,7-Dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy)methylene]bis(phosphonic acid) | C9H13NO7P2

[6,7-Dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy)methylene]bis(phosphonic acid)

  • Molecular FormulaC9H13NO7P2
  • Average mass309.150 Da
  • Monoisotopic mass309.016724 Da
  • ChemSpider ID22376111

More details:

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

[6,7-dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy)methanediyl]bis(phosphonic acid)
[6,7-Dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy)methylen]bis(phosphonsäure) [German] [ACD/IUPAC Name]
[6,7-Dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy)methylene]bis(phosphonic acid) [ACD/IUPAC Name]
Acide [6,7-dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy)méthylène]bis(phosphonique) [French] [ACD/IUPAC Name]
Phosphonic acid, [(6,7-dihydro-5H-cyclopenta[c]pyridin-7-yl)hydroxymethylene]bis- [ACD/Index Name]
[(6,7-Dihydro-5H-[2]pyrindin-7-yl)-hydroxy-phosphono-methyl]-phosphonic acid(NE10501)
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL317573/
rac-[6,7-dihydro-5H-cyclopenta[c]pyridin-7-yl(hydroxy) methylene]bis(phosphonicacid)

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

Density: 1.9±0.1 g/cm3
Boiling Point: 662.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.4±3.0 kJ/mol
Flash Point: 354.4±34.3 °C
Index of Refraction: 1.682
Molar Refractivity: 62.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -2.37
ACD/LogD (pH 5.5): -6.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 168 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 125.7±3.0 dyne/cm
Molar Volume: 164.3±3.0 cm3

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