200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88041-65-0
88041-65-0 | Phenol, 4-(1,1-dimethylethyl)-2-(propylsulfonyl)-
CAS No: 88041-65-0 Catalog No: AG004G46 MDL No:
Product Description
Catalog Number:
AG004G46
Chemical Name:
Phenol, 4-(1,1-dimethylethyl)-2-(propylsulfonyl)-
CAS Number:
88041-65-0
Molecular Formula:
C13H20O3S
Molecular Weight:
256.3611
IUPAC Name:
4-tert-butyl-2-propylsulfonylphenol
InChI:
InChI=1S/C13H20O3S/c1-5-8-17(15,16)12-9-10(13(2,3)4)6-7-11(12)14/h6-7,9,14H,5,8H2,1-4H3
InChI Key:
HLDUSZHPNFVNIS-UHFFFAOYSA-N
SMILES:
CCCS(=O)(=O)c1cc(ccc1O)C(C)(C)C
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.113g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.36g/mol
Monoisotopic Mass:
256.113g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.