Found 1 result

Search term: InChIKey=WLXWGAMHBLPVNB-AGRJPVHOSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (6Z,9Z,12Z)-methyl 6,9,12-hexadecatrienoate | C17H28O2

(6Z,9Z,12Z)-methyl 6,9,12-hexadecatrienoate

  • Molecular FormulaC17H28O2
  • Average mass264.403 Da
  • Monoisotopic mass264.208923 Da
  • ChemSpider ID29756748

  • Double-bond stereo - Double-bond stereo

More details:

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

(6Z,9Z,12Z)-6,9,12-Hexadécatriénoate de méthyle [French] [ACD/IUPAC Name]
(6Z,9Z,12Z)-methyl 6,9,12-hexadecatrienoate
6,9,12-Hexadecatrienoic acid, methyl ester, (6Z,9Z,12Z)- [ACD/Index Name]
873108-80-6 [RN]
Methyl (6Z,9Z,12Z)-6,9,12-hexadecatrienoate [ACD/IUPAC Name]
METHYL 6,9,12-HEXADECATRIENOATE, (6Z,9Z,12Z)-
Methyl-(6Z,9Z,12Z)-6,9,12-hexadecatrienoat [German] [ACD/IUPAC Name]
METHYL (6Z,9Z,12Z)-HEXADECA-6,9,12-TRIENOATE
Methyl 6,9,12-hexadecatrienoate [ACD/IUPAC Name]

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

Z83CSR22NW [DBID]
UNII:Z83CSR22NW [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: 344.8±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.9±3.0 kJ/mol
Flash Point: 101.8±23.2 °C
Index of Refraction: 1.476
Molar Refractivity: 82.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 5.97
ACD/LogD (pH 5.5): 5.60
ACD/BCF (pH 5.5): 10674.78
ACD/KOC (pH 5.5): 26612.67
ACD/LogD (pH 7.4): 5.60
ACD/BCF (pH 7.4): 10674.78
ACD/KOC (pH 7.4): 26612.67
Polar Surface Area: 26 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 31.4±3.0 dyne/cm
Molar Volume: 293.5±3.0 cm3

Click to predict properties on the Chemicalize site


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