2,5-Dichlorophenyl benzenesulfonate
TL;DR: 2,5-Dichlorophenyl benzenesulfonate (CAS 13659-50-2) is a chemical compound with molecular formula C12H8Cl2O3S and molecular weight 301.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dichlorophenyl) benzenesulfonate
Also Known As: 2,5-dichlorophenyl benzenesulfonate, (2,5-dichlorophenyl) benzenesulfonate, F3157-0519
| Molecular Formula | C12H8Cl2O3S |
|---|---|
| Molecular Weight | 301.96 g/mol |
| LogP | 3.7611 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.95712 |
| Heavy Atoms | 18 |
| Complexity | 654.27765 |
Chemical Identifiers
| CAS Number | 13659-50-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)Cl)Cl |
Product Overview
2,5-Dichlorophenyl benzenesulfonate (CAS 13659-50-2), with molecular formula C12H8Cl2O3S and molecular weight 301.96 g/mol. IUPAC: (2,5-dichlorophenyl) benzenesulfonate.
Chemical Property Profile of 2,5-Dichlorophenyl benzenesulfonate
Property Insights of 2,5-Dichlorophenyl benzenesulfonate
The XLogP value of 3.7611 indicates that 2,5-Dichlorophenyl benzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2,5-Dichlorophenyl benzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dichlorophenyl benzenesulfonate 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 2,5-Dichlorophenyl benzenesulfonate?
The CAS number of 2,5-Dichlorophenyl benzenesulfonate is 13659-50-2.
What is the molecular formula of 2,5-Dichlorophenyl benzenesulfonate?
The molecular formula of 2,5-Dichlorophenyl benzenesulfonate is C12H8Cl2O3S.
What is the molecular weight of 2,5-Dichlorophenyl benzenesulfonate?
The molecular weight of 2,5-Dichlorophenyl benzenesulfonate is 301.96 g/mol.
Where can I buy 2,5-Dichlorophenyl benzenesulfonate?
You can request a quote for 2,5-Dichlorophenyl benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichlorophenyl benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichlorophenyl benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.