ChemSpider 2D Image | [({5-[4-(Cyclopropyloxy)phenyl]-3-pyridinyl}amino)methylene]bis(phosphonic acid) | C15H18N2O7P2

[({5-[4-(Cyclopropyloxy)phenyl]-3-pyridinyl}amino)methylene]bis(phosphonic acid)

  • Molecular FormulaC15H18N2O7P2
  • Average mass400.260 Da
  • Monoisotopic mass400.058929 Da
  • ChemSpider ID28525411

More details:

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

[({5-[4-(Cyclopropyloxy)phenyl]-3-pyridinyl}amino)methylen]bis(phosphonsäure) [German] [ACD/IUPAC Name]
[({5-[4-(Cyclopropyloxy)phenyl]-3-pyridinyl}amino)methylene]bis(phosphonic acid) [ACD/IUPAC Name]
[({5-[4-(Cyclopropyloxy)phenyl]pyridin-3-Yl}amino)methanediyl]bis(Phosphonic Acid)
Acide [({5-[4-(cyclopropyloxy)phényl]-3-pyridinyl}amino)méthylène]bis(phosphonique) [French] [ACD/IUPAC Name]
Phosphonic acid, [[[5-[4-(cyclopropyloxy)phenyl]-3-pyridinyl]amino]methylene]bis- [ACD/Index Name]
JD5

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

Density: 1.7±0.1 g/cm3
Boiling Point: 808.1±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.2±3.0 kJ/mol
Flash Point: 442.5±37.1 °C
Index of Refraction: 1.698
Molar Refractivity: 92.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -2.30
ACD/LogD (pH 5.5): -6.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 94.4±3.0 dyne/cm
Molar Volume: 239.4±3.0 cm3

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