200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 138778-17-3
138778-17-3 | Octadecanoic acid, 18-(phenylsulfonyl)-
CAS No: 138778-17-3 Catalog No: AG0019JK MDL No:
Product Description
Catalog Number:
AG0019JK
Chemical Name:
Octadecanoic acid, 18-(phenylsulfonyl)-
CAS Number:
138778-17-3
Molecular Formula:
C24H40O4S
Molecular Weight:
424.6370
IUPAC Name:
18-(benzenesulfonyl)octadecanoic acid
InChI:
InChI=1S/C24H40O4S/c25-24(26)21-17-12-10-8-6-4-2-1-3-5-7-9-11-13-18-22-29(27,28)23-19-15-14-16-20-23/h14-16,19-20H,1-13,17-18,21-22H2,(H,25,26)
InChI Key:
OORVILNDZPVYCQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCCCCCCCCCCS(=O)(=O)c1ccccc1
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
424.265g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
424.64g/mol
Monoisotopic Mass:
424.265g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.