Docosahexaenoic acid, 1,2,3-propanetriyl ester


Chemical Name: Docosahexaenoic acid, 1,2,3-propanetriyl ester
CAS Number: 11094-59-0
Product Number: AG008V2C(AGN-PC-0NXIKB)
Synonyms:
MDL No:
Molecular Formula: C69H98O6
Molecular Weight: 1023.5128

Identification/Properties


Computed Properties
Molecular Weight:
1023.537g/mol
XLogP3:
19.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
50
Exact Mass:
1022.736g/mol
Monoisotopic Mass:
1022.736g/mol
Topological Polar Surface Area:
78.9A^2
Heavy Atom Count:
75
Formal Charge:
0
Complexity:
1850
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
18
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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