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122458-81-5 | 6,11-Eicosadienoic acid, (6Z,11Z)-
CAS No: 122458-81-5 Catalog No: AG00179A MDL No:
Product Description
Catalog Number:
AG00179A
Chemical Name:
6,11-Eicosadienoic acid, (6Z,11Z)-
CAS Number:
122458-81-5
Molecular Formula:
C20H36O2
Molecular Weight:
308.4986
IUPAC Name:
icosa-6,11-dienoic acid
InChI:
InChI=1S/C20H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,14-15H,2-8,11-13,16-19H2,1H3,(H,21,22)
InChI Key:
JCIGYPWFRJJJJC-UHFFFAOYSA-N
SMILES:
CCCCCCCC/C=C\CCC/C=C\CCCCC(=O)O
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.272g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.506g/mol
Monoisotopic Mass:
308.272g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
7.4
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