ChemSpider 2D Image | MFCD00673448 | C23H40O2

MFCD00673448

  • Molecular FormulaC23H40O2
  • Average mass348.563 Da
  • Monoisotopic mass348.302826 Da
  • ChemSpider ID21169424

  • Double-bond stereo - Double-bond stereo

More details:

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

(13Z,16Z,19Z)-13,16,19-Docosatriénoate de méthyle [French] [ACD/IUPAC Name]
108698-01-7 [RN]
13,16,19-Docosatrienoic acid, methyl ester, (13Z,16Z,19Z)- [ACD/Index Name]
docosatrienoic acid methyl ester
Methyl (13Z,16Z,19Z)-13,16,19-docosatrienoate [ACD/IUPAC Name]
methyl (13Z,16Z,19Z)-docosa-13,16,19-trienoate
Methyl-(13Z,16Z,19Z)-13,16,19-docosatrienoat [German] [ACD/IUPAC Name]
MFCD00673448
(13Z,?16Z,?19Z)?-13,?16,?19-?Docosatrienoic acid methyl ester
(13Z,16Z,19Z)-Methyl docosa-13,16,19-trienoate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

D3909_SIGMA [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: 427.0±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.2±3.0 kJ/mol
Flash Point: 93.1±18.5 °C
Index of Refraction: 1.475
Molar Refractivity: 110.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 9.09
ACD/LogD (pH 5.5): 7.89
ACD/BCF (pH 5.5): 586925.31
ACD/KOC (pH 5.5): 468513.91
ACD/LogD (pH 7.4): 7.89
ACD/BCF (pH 7.4): 586925.31
ACD/KOC (pH 7.4): 468513.91
Polar Surface Area: 26 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 32.0±3.0 dyne/cm
Molar Volume: 392.5±3.0 cm3

Click to predict properties on the Chemicalize site


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