200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88462-48-0
88462-48-0 | 9,11-Dodecadienoic acid, 12-(pentylthio)-, (E,Z)-
CAS No: 88462-48-0 Catalog No: AG004BW8 MDL No:
Product Description
Catalog Number:
AG004BW8
Chemical Name:
9,11-Dodecadienoic acid, 12-(pentylthio)-, (E,Z)-
CAS Number:
88462-48-0
Molecular Formula:
C17H30O2S
Molecular Weight:
298.4839
IUPAC Name:
12-pentylsulfanyldodeca-9,11-dienoic acid
InChI:
InChI=1S/C17H30O2S/c1-2-3-12-15-20-16-13-10-8-6-4-5-7-9-11-14-17(18)19/h8,10,13,16H,2-7,9,11-12,14-15H2,1H3,(H,18,19)
InChI Key:
KWCBMIQCBBPRHN-UHFFFAOYSA-N
SMILES:
CCCCCS/C=C\C=C\CCCCCCCC(=O)O
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.197g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
298.485g/mol
Monoisotopic Mass:
298.197g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.