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85589-32-8 | 8,11,14,17-Octadecatetraenoic acid, (8Z,11Z,14Z)-
CAS No: 85589-32-8 Catalog No: AG004U5R MDL No:
Product Description
Catalog Number:
AG004U5R
Chemical Name:
8,11,14,17-Octadecatetraenoic acid, (8Z,11Z,14Z)-
CAS Number:
85589-32-8
Molecular Formula:
C18H28O2
Molecular Weight:
276.4137
IUPAC Name:
octadeca-8,11,14,17-tetraenoic acid
InChI:
InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2,4-5,7-8,10-11H,1,3,6,9,12-17H2,(H,19,20)
InChI Key:
MYJWKIHFIMVYGF-UHFFFAOYSA-N
SMILES:
C=CC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.209g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.42g/mol
Monoisotopic Mass:
276.209g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
XLogP3:
5.6
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