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157892-09-6 | 8,10,12,14,16-Octadecapentaenoic acid, (8E,10E,12E,14E,16E)-
CAS No: 157892-09-6 Catalog No: AG001PSC MDL No:
Product Description
Catalog Number:
AG001PSC
Chemical Name:
8,10,12,14,16-Octadecapentaenoic acid, (8E,10E,12E,14E,16E)-
CAS Number:
157892-09-6
Molecular Formula:
C18H26O2
Molecular Weight:
274.3978
IUPAC Name:
octadeca-8,10,12,14,16-pentaenoic acid
InChI:
InChI=1S/C18H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-11H,12-17H2,1H3,(H,19,20)
InChI Key:
LXBCNFIWOCGTTN-UHFFFAOYSA-N
SMILES:
C/C=C/C=C/C=C/C=C/C=C/CCCCCCC(=O)O
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.193g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.404g/mol
Monoisotopic Mass:
274.193g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
5
XLogP3:
5.6
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