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Search term: InChIKey=UPIRHFZFPVEDCF-NQLNTKRDSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | Methyl (13Z,16Z)-13,16-docosadienoate | C23H42O2

Methyl (13Z,16Z)-13,16-docosadienoate

  • Molecular FormulaC23H42O2
  • Average mass350.578 Da
  • Monoisotopic mass350.318481 Da
  • ChemSpider ID21169417
  • Double-bond stereo - Double-bond stereo

More details:

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

(13Z,16Z)-13,16-Docosadiénoate de méthyle [French] [ACD/IUPAC Name]
13,16-Docosadienoic acid, methyl ester, (13Z,16Z)- [ACD/Index Name]
Methyl (13Z,16Z)-13,16-docosadienoate [ACD/IUPAC Name]
Methyl-(13Z,16Z)-13,16-docosadienoat [German] [ACD/IUPAC Name]
(13Z,?16Z)?-13,?16-?Docosadienoic acid, methyl ester
(13Z,16Z)-Methyl docosa-13,16-dienoate
13Z,16Z-docosadienoic acid, methyl ester
61012-47-3 [RN]
cis-13,16-Docasadienoic acid, methyl ester

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


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

Density: 0.9±0.1 g/cm3
Boiling Point: 425.1±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 88.9±18.5 °C
Index of Refraction: 1.466
Molar Refractivity: 110.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 9.77
ACD/LogD (pH 5.5): 8.39
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 867416.44
ACD/LogD (pH 7.4): 8.39
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 867416.44
Polar Surface Area: 26 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 31.7±3.0 dyne/cm
Molar Volume: 398.9±3.0 cm3

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