Found 1 result

Search term: InChIKey=VYFSOVMGRZVLMP-AFJQJTPPSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | (9Z,12Z)-methyl 9,12-hexadecadienoate | C17H30O2

(9Z,12Z)-methyl 9,12-hexadecadienoate

  • Molecular FormulaC17H30O2
  • Average mass266.419 Da
  • Monoisotopic mass266.224579 Da
  • ChemSpider ID26324045
  • Double-bond stereo - Double-bond stereo


More details:






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

(9Z,12Z)-9,12-Hexadécadiénoate de méthyle [French] [ACD/IUPAC Name]
(9Z,12Z)-methyl 9,12-hexadecadienoate
31327-61-4 [RN]
9,12-Hexadecadienoic acid, methyl ester, (9Z,12Z)- [ACD/Index Name]
Methyl (9Z,12Z)-9,12-hexadecadienoate [ACD/IUPAC Name]
METHYL 9,12-HEXADECADIENOATE, (9Z,12Z)-
Methyl-(9Z,12Z)-9,12-hexadecadienoat [German] [ACD/IUPAC Name]
METHYL 9(Z),12(Z)HEXADECADIENOATE

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

5PH37SJ2NL [DBID]
UNII:5PH37SJ2NL [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 342.2±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.6±3.0 kJ/mol
Flash Point: 97.2±20.4 °C
Index of Refraction: 1.464
Molar Refractivity: 82.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 6.58
ACD/LogD (pH 5.5): 6.15
ACD/BCF (pH 5.5): 27739.71
ACD/KOC (pH 5.5): 52717.79
ACD/LogD (pH 7.4): 6.15
ACD/BCF (pH 7.4): 27739.71
ACD/KOC (pH 7.4): 52717.79
Polar Surface Area: 26 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 31.0±3.0 dyne/cm
Molar Volume: 299.9±3.0 cm3

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