3-(4-Methylphenoxy)benzenesulphonyl chloride
TL;DR: 3-(4-Methylphenoxy)benzenesulphonyl chloride (CAS 885950-86-7) 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.
3-(4-methylphenoxy)benzenesulfonyl chloride
Also Known As: 3-(4-Methylphenoxy)benzenesulphonyl chloride, 3-(4-methylphenoxy)benzenesulfonyl Chloride, [3-(4-METHYLPHENOXY)PHENYL]SULFONYL CHLORIDE, 3-(P-tolyloxy)benzenesulfonylchloride, 3PBS-Q06-0
| Molecular Formula | C13H11ClO3S |
|---|---|
| Molecular Weight | 282.01 g/mol |
| LogP | 3.71482 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.01175 |
| Heavy Atoms | 18 |
| Complexity | 648.1915 |
Chemical Identifiers
| CAS Number | 885950-86-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=CC(=CC=C2)S(=O)(=O)Cl |
Product Overview
3-(4-Methylphenoxy)benzenesulphonyl chloride (CAS 885950-86-7), with molecular formula C13H11ClO3S and molecular weight 282.01 g/mol. IUPAC: 3-(4-methylphenoxy)benzenesulfonyl chloride.
Chemical Property Profile of 3-(4-Methylphenoxy)benzenesulphonyl chloride
Property Insights of 3-(4-Methylphenoxy)benzenesulphonyl chloride
The XLogP value of 3.71482 indicates that 3-(4-Methylphenoxy)benzenesulphonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 3-(4-Methylphenoxy)benzenesulphonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Methylphenoxy)benzenesulphonyl chloride 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 3-(4-Methylphenoxy)benzenesulphonyl chloride?
The CAS number of 3-(4-Methylphenoxy)benzenesulphonyl chloride is 885950-86-7.
What is the molecular formula of 3-(4-Methylphenoxy)benzenesulphonyl chloride?
The molecular formula of 3-(4-Methylphenoxy)benzenesulphonyl chloride is C13H11ClO3S.
What is the molecular weight of 3-(4-Methylphenoxy)benzenesulphonyl chloride?
The molecular weight of 3-(4-Methylphenoxy)benzenesulphonyl chloride is 282.01 g/mol.
Where can I buy 3-(4-Methylphenoxy)benzenesulphonyl chloride?
You can request a quote for 3-(4-Methylphenoxy)benzenesulphonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methylphenoxy)benzenesulphonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methylphenoxy)benzenesulphonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.