ChemSpider 2D Image | (3,3,4-Triethyl-1,4-hexanediyl)bis(phosphonic acid) | C12H28O6P2

(3,3,4-Triethyl-1,4-hexanediyl)bis(phosphonic acid)

  • Molecular FormulaC12H28O6P2
  • Average mass330.295 Da
  • Monoisotopic mass330.136108 Da
  • ChemSpider ID122746492

More details:

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

(3,3,4-Triethyl-1,4-hexandiyl)bis(phosphonsäure) [German] [ACD/IUPAC Name]
(3,3,4-Triethyl-1,4-hexanediyl)bis(phosphonic acid) [ACD/IUPAC Name]
Acide (3,3,4-triéthyl-1,4-hexanediyl)bis(phosphonique) [French] [ACD/IUPAC Name]
Phosphonic acid, (1,1,2,2-tetraethyl-1,4-butanediyl)bis- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 534.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 88.7±6.0 kJ/mol
Flash Point: 277.0±32.9 °C
Index of Refraction: 1.496
Molar Refractivity: 77.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.09
ACD/LogD (pH 5.5): -4.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 135 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 265.0±3.0 cm3

Click to predict properties on the Chemicalize site


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