200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 82965-02-4
82965-02-4 | Benzenesulfonic acid, 2,4,6-trimethyl-, hexyl ester
CAS No: 82965-02-4 Catalog No: AG005EHA MDL No:
Product Description
Catalog Number:
AG005EHA
Chemical Name:
Benzenesulfonic acid, 2,4,6-trimethyl-, hexyl ester
CAS Number:
82965-02-4
Molecular Formula:
C15H24O3S
Molecular Weight:
284.4143
IUPAC Name:
hexyl 2,4,6-trimethylbenzenesulfonate
InChI:
InChI=1S/C15H24O3S/c1-5-6-7-8-9-18-19(16,17)15-13(3)10-12(2)11-14(15)4/h10-11H,5-9H2,1-4H3
InChI Key:
KCCXOWQDWKFJDE-UHFFFAOYSA-N
SMILES:
CCCCCCOS(=O)(=O)c1c(C)cc(cc1C)C
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.145g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.414g/mol
Monoisotopic Mass:
284.145g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.