ChemSpider 2D Image | Pentacontane | C50H102

Pentacontane

  • Molecular FormulaC50H102
  • Average mass703.345 Da
  • Monoisotopic mass702.798157 Da
  • ChemSpider ID73140

More details:






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

1807879
229-534-4 [EINECS]
6596-40-3 [RN]
MFCD00042907
n-Pentacontane
Pentacontan [German] [ACD/IUPAC Name]
Pentacontane [ACD/Index Name] [ACD/IUPAC Name] [Wiki]
Pentacontane [French] [ACD/IUPAC Name]
[6596-40-3]

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

442743_SUPELCO [DBID]
48595_SUPELCO [DBID]
76491_FLUKA [DBID]
P0559_SIGMA [DBID]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 578.4±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 83.4±0.8 kJ/mol
Flash Point: 507.6±9.4 °C
Index of Refraction: 1.460
Molar Refractivity: 233.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 47
#Rule of 5 Violations: 2
ACD/LogP: 27.32
ACD/LogD (pH 5.5): 24.85
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 24.85
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 92.6±0.5 10-24cm3
Surface Tension: 31.4±3.0 dyne/cm
Molar Volume: 853.9±3.0 cm3

Click to predict properties on the Chemicalize site






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