200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 129101-47-9
129101-47-9 | 6,9,11-Octadecatrienoic acid, 13-hydroperoxy-, (6Z,9Z,11E)-
CAS No: 129101-47-9 Catalog No: AG000YUQ MDL No:
Product Description
Catalog Number:
AG000YUQ
Chemical Name:
6,9,11-Octadecatrienoic acid, 13-hydroperoxy-, (6Z,9Z,11E)-
CAS Number:
129101-47-9
Molecular Formula:
C18H30O4
Molecular Weight:
310.4284
IUPAC Name:
13-hydroperoxyoctadeca-6,9,11-trienoic acid
InChI:
InChI=1S/C18H30O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h4,6-7,9,12,15,17,21H,2-3,5,8,10-11,13-14,16H2,1H3,(H,19,20)
InChI Key:
LYFGXCQTRBQQMX-UHFFFAOYSA-N
SMILES:
CCCCCC(/C=C/C=C\C/C=C\CCCCC(=O)O)OO
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.214g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
310.434g/mol
Monoisotopic Mass:
310.214g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
3
XLogP3:
4.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.