ChemSpider 2D Image | Diisocetyl adipate | C38H74O4

Diisocetyl adipate

  • Molecular FormulaC38H74O4
  • Average mass594.992 Da
  • Monoisotopic mass594.558716 Da
  • ChemSpider ID97842

More details:

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

261-857-6 [EINECS]
59686-69-0 [RN]
Adipate de bis(14-méthylpentadécyle) [French] [ACD/IUPAC Name]
Bis(14-methylpentadecyl) adipate [ACD/IUPAC Name]
Bis(14-methylpentadecyl)adipat [German] [ACD/IUPAC Name]
Diisocetyl adipate
Hexanedioic acid, bis(14-methylpentadecyl) ester [ACD/Index Name]
1,6-BIS(14-METHYLPENTADECYL) HEXANEDIOATE
BIS(14-METHYLPENTADECYL) HEXANEDIOATE
diisohexadecyl adipate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

14885YC9LU [DBID]
UNII:14885YC9LU [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 548.0±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 244.9±19.6 °C
Index of Refraction: 1.460
Molar Refractivity: 181.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 35
#Rule of 5 Violations: 2
ACD/LogP: 16.60
ACD/LogD (pH 5.5): 13.73
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.73
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 53 Å2
Polarizability: 72.0±0.5 10-24cm3
Surface Tension: 32.8±3.0 dyne/cm
Molar Volume: 663.5±3.0 cm3

Click to predict properties on the Chemicalize site


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