ChemSpider 2D Image | Pentaoctacontane | C85H172

Pentaoctacontane

  • Molecular FormulaC85H172
  • Average mass1194.275 Da
  • Monoisotopic mass1193.345947 Da
  • ChemSpider ID19034017

More details:






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

Pentaoctacontan [German] [ACD/IUPAC Name]
Pentaoctacontane [ACD/Index Name] [ACD/IUPAC Name]
Pentaoctacontane [French] [ACD/IUPAC Name]
7719-96-2 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.8±0.1 g/cm3
Boiling Point: 691.7±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 97.7±0.8 kJ/mol
Flash Point: 836.6±10.8 °C
Index of Refraction: 1.465
Molar Refractivity: 395.8±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 82
#Rule of 5 Violations: 2
ACD/LogP: 45.92
ACD/LogD (pH 5.5): 43.40
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 43.40
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 156.9±0.5 10-24cm3
Surface Tension: 32.3±3.0 dyne/cm
Molar Volume: 1431.6±3.0 cm3

Click to predict properties on the Chemicalize site