ChemSpider 2D Image | 1,6-Diisocyanato(2,2,3,3,4,4,5,5-~2~H_8_)hexane | C8H4D8N2O2

1,6-Diisocyanato(2,2,3,3,4,4,5,5-2H8)hexane

  • Molecular FormulaC8H4D8N2O2
  • Average mass176.242 Da
  • Monoisotopic mass176.140091 Da
  • ChemSpider ID107437300

  • Non-standard isotope - Non-standard isotope

More details:

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

1,6-Diisocyanato(2,2,3,3,4,4,5,5-2H8)hexan [German] [ACD/IUPAC Name]
1,6-Diisocyanato(2,2,3,3,4,4,5,5-2H8)hexane [ACD/IUPAC Name]
1,6-Diisocyanato(2,2,3,3,4,4,5,5-2H8)hexane [French] [ACD/IUPAC Name]
Hexane-2,2,3,3,4,4,5,5-d8, 1,6-diisocyanato- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 255.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 140.0±0.0 °C
Index of Refraction: 1.483
Molar Refractivity: 47.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.03
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 93.89
ACD/KOC (pH 5.5): 898.71
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 93.89
ACD/KOC (pH 7.4): 898.71
Polar Surface Area: 59 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 39.4±7.0 dyne/cm
Molar Volume: 165.3±7.0 cm3

Click to predict properties on the Chemicalize site


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