5,8,11-Eicosatrienoic acid, methyl ester, (Z,Z,Z)-


Chemical Name: 5,8,11-Eicosatrienoic acid, methyl ester, (Z,Z,Z)-
CAS Number: 14602-39-2
Product Number: AG001DMW(AGN-PC-0O3859)
Synonyms:
MDL No: MFCD00133185
Molecular Formula: C21H36O2
Molecular Weight: 320.5093

Identification/Properties


Computed Properties
Molecular Weight:
320.517g/mol
XLogP3:
7.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
16
Exact Mass:
320.272g/mol
Monoisotopic Mass:
320.272g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
340
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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