P-Tolyl benzenesulfinate
TL;DR: P-Tolyl benzenesulfinate (CAS 60270-05-5) is a chemical compound with molecular formula C13H12O2S and molecular weight 232.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl) benzenesulfinate
Also Known As: P-TOLYL BENZENESULFINATE, (4-methylphenyl) benzenesulfinate, 4-METHYLPHENYL BENZENESULFINATE, Benzenesulfinic acid, 4-methylphenyl ester, 1-(benzenesulfinyloxy)-4-methyl-benzene
| Molecular Formula | C13H12O2S |
|---|---|
| Molecular Weight | 232.06 g/mol |
| LogP | 3.09662 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.0558 |
| Heavy Atoms | 16 |
| Complexity | 477.0456 |
Chemical Identifiers
| CAS Number | 60270-05-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OS(=O)C2=CC=CC=C2 |
Product Overview
P-Tolyl benzenesulfinate (CAS 60270-05-5), with molecular formula C13H12O2S and molecular weight 232.06 g/mol. IUPAC: (4-methylphenyl) benzenesulfinate.
Chemical Property Profile of P-Tolyl benzenesulfinate
Property Insights of P-Tolyl benzenesulfinate
The XLogP value of 3.09662 indicates that P-Tolyl benzenesulfinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, P-Tolyl benzenesulfinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, P-Tolyl benzenesulfinate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of P-Tolyl benzenesulfinate?
The CAS number of P-Tolyl benzenesulfinate is 60270-05-5.
What is the molecular formula of P-Tolyl benzenesulfinate?
The molecular formula of P-Tolyl benzenesulfinate is C13H12O2S.
What is the molecular weight of P-Tolyl benzenesulfinate?
The molecular weight of P-Tolyl benzenesulfinate is 232.06 g/mol.
Where can I buy P-Tolyl benzenesulfinate?
You can request a quote for P-Tolyl benzenesulfinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for P-Tolyl benzenesulfinate?
Yes, KEHONG BIO provides custom synthesis services for P-Tolyl benzenesulfinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.