ChemSpider 2D Image | Icosabutate | C24H38O3

Icosabutate

  • Molecular FormulaC24H38O3
  • Average mass374.557 Da
  • Monoisotopic mass374.282104 Da
  • ChemSpider ID35143511

  • Double-bond stereo - Double-bond stereo

More details:

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

1253909-57-7 [RN]
2-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Icosapentaen-1-yloxy]butanoic acid [ACD/IUPAC Name]
2-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Icosapentaen-1-yloxy]butansäure [German] [ACD/IUPAC Name]
562599X5JL
Acide 2-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-icosapentaén-1-yloxy]butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2-[(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-eicosapentaen-1-yloxy]- [ACD/Index Name]
Icosabutate [USAN]
PRB-01022
PRC-4016
rac-2-[(5Z,8Z,11Z,14Z,17Z)icosa-5,8,11,14,17-pentaen-1-yloxy]butanoic acid
More...

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

9888 [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: 496.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 83.7±6.0 kJ/mol
Flash Point: 157.1±22.2 °C
Index of Refraction: 1.504
Molar Refractivity: 116.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 7.00
ACD/LogD (pH 5.5): 4.60
ACD/BCF (pH 5.5): 659.12
ACD/KOC (pH 5.5): 1080.77
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 16.60
ACD/KOC (pH 7.4): 27.22
Polar Surface Area: 47 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 35.5±3.0 dyne/cm
Molar Volume: 394.1±3.0 cm3

Click to predict properties on the Chemicalize site


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