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Search term: InChIKey=ABGHYAFHPINIHF-ZKWNWVNESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | MFCD00673449 | C23H38O2

MFCD00673449

  • Molecular FormulaC23H38O2
  • Average mass346.547 Da
  • Monoisotopic mass346.287170 Da
  • ChemSpider ID21169445

  • Double-bond stereo - Double-bond stereo

More details:

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

(7Z,10Z,13Z,16Z)-7,10,13,16-Docosatétraénoate de méthyle [French] [ACD/IUPAC Name]
13487-42-8 [RN]
7,10,13,16-Docosatetraenoic acid, methyl ester, (7Z,10Z,13Z,16Z)- [ACD/Index Name]
Methyl (7Z,10Z,13Z,16Z)-7,10,13,16-docosatetraenoate [ACD/IUPAC Name]
Methyl-(7Z,10Z,13Z,16Z)-7,10,13,16-docosatetraenoat [German] [ACD/IUPAC Name]
MFCD00673449
7-CIS-10-CIS-13-CIS-16-CIS-DOCOSATETRAENOIC ACID METHYL ESTER
cis-7,10,13,16-Docosatetraenoic acid methyl ester
cis-7,10,13,16-Docosatetraenoic acid, methyl ester
methyl (7Z,10Z,13Z,16Z)-docosa-7,10,13,16-tetraenoate

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

D3534_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: 432.1±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 99.2±21.2 °C
Index of Refraction: 1.485
Molar Refractivity: 110.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 8.41
ACD/LogD (pH 5.5): 7.69
ACD/BCF (pH 5.5): 414017.97
ACD/KOC (pH 5.5): 364951.28
ACD/LogD (pH 7.4): 7.69
ACD/BCF (pH 7.4): 414017.97
ACD/KOC (pH 7.4): 364951.28
Polar Surface Area: 26 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 32.3±3.0 dyne/cm
Molar Volume: 386.1±3.0 cm3

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