200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88852-50-0
88852-50-0 | 5,8,10,12-Tridecatetraenoic acid, 13-(3-pentyloxiranyl)-
CAS No: 88852-50-0 Catalog No: AG004BKL MDL No:
Product Description
Catalog Number:
AG004BKL
Chemical Name:
5,8,10,12-Tridecatetraenoic acid, 13-(3-pentyloxiranyl)-
CAS Number:
88852-50-0
Molecular Formula:
C20H30O3
Molecular Weight:
318.4504
IUPAC Name:
13-(3-pentyloxiran-2-yl)trideca-5,8,10,12-tetraenoic acid
InChI:
InChI=1S/C20H30O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h4,6-10,13,16,18-19H,2-3,5,11-12,14-15,17H2,1H3,(H,21,22)
InChI Key:
URDQSJSEGRMOIT-UHFFFAOYSA-N
SMILES:
CCCCCC1OC1C=CC=CC=CCC=CCCCC(=O)O
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.219g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.457g/mol
Monoisotopic Mass:
318.219g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
4
XLogP3:
5.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.