Found 90 results

Search term: MF = 'C_{31}H_{52}O_{5}'
ChemSpider 2D Image | 1,3-Bis(octyloxy)-2-propanyl 4-(2,2-dimethylpropanoyl)benzoate | C31H52O5

1,3-Bis(octyloxy)-2-propanyl 4-(2,2-dimethylpropanoyl)benzoate

  • Molecular FormulaC31H52O5
  • Average mass504.742 Da
  • Monoisotopic mass504.381470 Da
  • ChemSpider ID8943184

More details:

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

1,3-Bis(octyloxy)-2-propanyl 4-(2,2-dimethylpropanoyl)benzoate [ACD/IUPAC Name]
1,3-Bis(octyloxy)-2-propanyl-4-(2,2-dimethylpropanoyl)benzoat [German] [ACD/IUPAC Name]
1,3-bis(octyloxy)propan-2-yl 4-(2,2-dimethylpropanoyl)benzoate
4-(2,2-Diméthylpropanoyl)benzoate de 1,3-bis(octyloxy)-2-propanyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(2,2-dimethyl-1-oxopropyl)-, 2-(octyloxy)-1-[(octyloxy)methyl]ethyl ester [ACD/Index Name]
4-(2,2-Dimethyl-propionyl)-benzoic acid 2-octyloxy-1-octyloxymethyl-ethyl ester

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

Density: 1.0±0.1 g/cm3
Boiling Point: 568.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 247.0±16.7 °C
Index of Refraction: 1.485
Molar Refractivity: 148.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 2
ACD/LogP: 10.26
ACD/LogD (pH 5.5): 9.59
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3911689.00
ACD/LogD (pH 7.4): 9.59
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 3911689.00
Polar Surface Area: 62 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 518.6±3.0 cm3

Click to predict properties on the Chemicalize site


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