ChemSpider 2D Image | [1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)cyclohexyl]phosphonic acid | C14H20NO5P

[1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)cyclohexyl]phosphonic acid

  • Molecular FormulaC14H20NO5P
  • Average mass313.286 Da
  • Monoisotopic mass313.107910 Da
  • ChemSpider ID22443367

More details:

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

[1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)cyclohexyl]phosphonic acid [ACD/IUPAC Name]
[1-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)cyclohexyl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)cyclohexyl]phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [1-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]cyclohexyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 548.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 285.3±32.9 °C
Index of Refraction: 1.600
Molar Refractivity: 76.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.16
ACD/LogD (pH 5.5): -1.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 63.3±5.0 dyne/cm
Molar Volume: 224.1±5.0 cm3

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