2,4,6-Trichlorophenyl methanesulfonate
TL;DR: 2,4,6-Trichlorophenyl methanesulfonate (CAS 129248-61-9) is a chemical compound with molecular formula C7H5Cl3O3S and molecular weight 273.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4,6-trichlorophenyl) methanesulfonate
Also Known As: 2,4,6-TRICHLOROPHENYL METHANESULFONATE, (2,4,6-trichlorophenyl) methanesulfonate, 1,3,5-trichloro-2-methylsulfonyloxy-benzene, 664-884-5, RefChem:442893
| Molecular Formula | C7H5Cl3O3S |
|---|---|
| Molecular Weight | 273.90 g/mol |
| LogP | 2.9852 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.9025 |
| Heavy Atoms | 14 |
| Complexity | 432.24298 |
Chemical Identifiers
| CAS Number | 129248-61-9 |
|---|---|
| SMILES | CS(=O)(=O)OC1=C(C=C(C=C1Cl)Cl)Cl |
Product Overview
2,4,6-Trichlorophenyl methanesulfonate (CAS 129248-61-9), with molecular formula C7H5Cl3O3S and molecular weight 273.90 g/mol. IUPAC: (2,4,6-trichlorophenyl) methanesulfonate.
Chemical Property Profile of 2,4,6-Trichlorophenyl methanesulfonate
Property Insights of 2,4,6-Trichlorophenyl methanesulfonate
The XLogP value of 2.9852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Trichlorophenyl methanesulfonate. With a topological polar surface area (TPSA) of 43.37 Ų, 2,4,6-Trichlorophenyl methanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Trichlorophenyl methanesulfonate 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 2,4,6-Trichlorophenyl methanesulfonate?
The CAS number of 2,4,6-Trichlorophenyl methanesulfonate is 129248-61-9.
What is the molecular formula of 2,4,6-Trichlorophenyl methanesulfonate?
The molecular formula of 2,4,6-Trichlorophenyl methanesulfonate is C7H5Cl3O3S.
What is the molecular weight of 2,4,6-Trichlorophenyl methanesulfonate?
The molecular weight of 2,4,6-Trichlorophenyl methanesulfonate is 273.90 g/mol.
Where can I buy 2,4,6-Trichlorophenyl methanesulfonate?
You can request a quote for 2,4,6-Trichlorophenyl methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trichlorophenyl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trichlorophenyl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.