2-Chlorophenyl phenylmethanesulfonate
TL;DR: 2-Chlorophenyl phenylmethanesulfonate (CAS 62162-73-6) is a chemical compound with molecular formula C13H11ClO3S and molecular weight 282.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chlorophenyl) phenylmethanesulfonate
Also Known As: 2-chlorophenyl phenylmethanesulfonate, (2-chlorophenyl) phenylmethanesulfonate, 2-Chlorophenyl benzenemethanesulfonate, Benzenemethanesulfonic acid, 2-chlorophenyl ester, AL-398/25017051
| Molecular Formula | C13H11ClO3S |
|---|---|
| Molecular Weight | 282.01 g/mol |
| LogP | 3.2488 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.01175 |
| Heavy Atoms | 18 |
| Complexity | 623.69446 |
Chemical Identifiers
| CAS Number | 62162-73-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CS(=O)(=O)OC2=CC=CC=C2Cl |
Product Overview
2-Chlorophenyl phenylmethanesulfonate (CAS 62162-73-6), with molecular formula C13H11ClO3S and molecular weight 282.01 g/mol. IUPAC: (2-chlorophenyl) phenylmethanesulfonate.
Chemical Property Profile of 2-Chlorophenyl phenylmethanesulfonate
Property Insights of 2-Chlorophenyl phenylmethanesulfonate
The XLogP value of 3.2488 indicates that 2-Chlorophenyl phenylmethanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Chlorophenyl phenylmethanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorophenyl phenylmethanesulfonate has 0 hydrogen bond donor(s) and 3 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 2-Chlorophenyl phenylmethanesulfonate?
The CAS number of 2-Chlorophenyl phenylmethanesulfonate is 62162-73-6.
What is the molecular formula of 2-Chlorophenyl phenylmethanesulfonate?
The molecular formula of 2-Chlorophenyl phenylmethanesulfonate is C13H11ClO3S.
What is the molecular weight of 2-Chlorophenyl phenylmethanesulfonate?
The molecular weight of 2-Chlorophenyl phenylmethanesulfonate is 282.01 g/mol.
Where can I buy 2-Chlorophenyl phenylmethanesulfonate?
You can request a quote for 2-Chlorophenyl phenylmethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorophenyl phenylmethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorophenyl phenylmethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.