ChemSpider 2D Image | [2-(3-Pyridinylamino)-1,1-ethanediyl]bis(phosphonic acid) | C7H12N2O6P2

[2-(3-Pyridinylamino)-1,1-ethanediyl]bis(phosphonic acid)

  • Molecular FormulaC7H12N2O6P2
  • Average mass282.128 Da
  • Monoisotopic mass282.017059 Da
  • ChemSpider ID23278566

More details:

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

[2-(3-Pyridinylamino)-1,1-ethandiyl]bis(phosphonsäure) [German] [ACD/IUPAC Name]
[2-(3-Pyridinylamino)-1,1-ethanediyl]bis(phosphonic acid) [ACD/IUPAC Name]
[2-(pyridin-3-ylamino)ethane-1,1-diyl]bis(phosphonic acid)
Acide [2-(3-pyridinylamino)-1,1-éthanediyl]bis(phosphonique) [French] [ACD/IUPAC Name]
Phosphonic acid, [2-(3-pyridinylamino)ethylidene]bis- [ACD/Index Name]
[2-(3-pyridinylamino)ethylidene]-1,1-bisphosphonate
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL374148/

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

Density: 1.8±0.1 g/cm3
Boiling Point: 720.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.5±3.0 kJ/mol
Flash Point: 389.4±35.7 °C
Index of Refraction: 1.665
Molar Refractivity: 58.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -4.35
ACD/LogD (pH 5.5): -7.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 109.3±3.0 dyne/cm
Molar Volume: 157.3±3.0 cm3

Click to predict properties on the Chemicalize site


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