Vinyl 6-chlorotoluene-3-sulphonate
TL;DR: Vinyl 6-chlorotoluene-3-sulphonate (CAS 84540-41-0) is a chemical compound with molecular formula C9H9ClO3S and molecular weight 232.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl 4-chloro-3-methylbenzenesulfonate
Also Known As: Vinyl 6-chlorotoluene-3-sulphonate, EINECS 283-134-4, ethenyl 4-chloro-3-methylbenzenesulfonate, vinyl6-chlorotoluene-3-sulphonate, VINYL 6-CHLOROTOLUENE-3-SULFONATE
| Molecular Formula | C9H9ClO3S |
|---|---|
| Molecular Weight | 232.00 g/mol |
| LogP | 2.49722 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.9961 |
| Heavy Atoms | 14 |
| Complexity | 451.1249 |
Chemical Identifiers
| CAS Number | 84540-41-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)OC=C)Cl |
Product Overview
Vinyl 6-chlorotoluene-3-sulphonate (CAS 84540-41-0), with molecular formula C9H9ClO3S and molecular weight 232.00 g/mol. IUPAC: ethenyl 4-chloro-3-methylbenzenesulfonate.
Chemical Property Profile of Vinyl 6-chlorotoluene-3-sulphonate
Property Insights of Vinyl 6-chlorotoluene-3-sulphonate
The XLogP value of 2.49722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vinyl 6-chlorotoluene-3-sulphonate. With a topological polar surface area (TPSA) of 43.37 Ų, Vinyl 6-chlorotoluene-3-sulphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vinyl 6-chlorotoluene-3-sulphonate 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 Vinyl 6-chlorotoluene-3-sulphonate?
The CAS number of Vinyl 6-chlorotoluene-3-sulphonate is 84540-41-0.
What is the molecular formula of Vinyl 6-chlorotoluene-3-sulphonate?
The molecular formula of Vinyl 6-chlorotoluene-3-sulphonate is C9H9ClO3S.
What is the molecular weight of Vinyl 6-chlorotoluene-3-sulphonate?
The molecular weight of Vinyl 6-chlorotoluene-3-sulphonate is 232.00 g/mol.
Where can I buy Vinyl 6-chlorotoluene-3-sulphonate?
You can request a quote for Vinyl 6-chlorotoluene-3-sulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vinyl 6-chlorotoluene-3-sulphonate?
Yes, KEHONG BIO provides custom synthesis services for Vinyl 6-chlorotoluene-3-sulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.