ChemSpider 2D Image | 1-Pentacontanol | C50H102O

1-Pentacontanol

  • Molecular FormulaC50H102O
  • Average mass719.344 Da
  • Monoisotopic mass718.793091 Da
  • ChemSpider ID474888

More details:

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

1-Pentacontanol [ACD/Index Name] [ACD/IUPAC Name]
1-Pentacontanol [German] [ACD/Index Name] [ACD/IUPAC Name]
1-Pentacontanol [French] [ACD/Index Name] [ACD/IUPAC Name]
40710-43-8 [RN]
1-Hydroxytriacontane
1-Triacontanol [ACD/Index Name] [ACD/IUPAC Name]
593-50-0 [RN]
C30-50 ALCOHOLS
EINECS 209-794-5
Melissyl alcohol
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

RJ0ZGV102N [DBID]
237809_ALDRICH [DBID]
AI3-20480 [DBID]
C08392 [DBID]
CHEBI:28409 [DBID]
LMFA05000006 [DBID]
NSC 402492 [DBID]
NSC 405588 [DBID]
NSC402492 [DBID]
NSC405588 [DBID]
More...

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

Density: 0.8±0.1 g/cm3
Boiling Point: 555.0±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 96.1±6.0 kJ/mol
Flash Point: 27.3±7.4 °C
Index of Refraction: 1.465
Molar Refractivity: 235.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 48
#Rule of 5 Violations: 2
ACD/LogP: 25.32
ACD/LogD (pH 5.5): 22.66
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 22.66
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 20 Å2
Polarizability: 93.3±0.5 10-24cm3
Surface Tension: 32.8±3.0 dyne/cm
Molar Volume: 851.4±3.0 cm3

Click to predict properties on the Chemicalize site


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