2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol
TL;DR: 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol (CAS 64181-84-6) is a chemical compound with molecular formula C16H16Cl2O3S and molecular weight 358.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-6-[(2,4,6-trimethylphenyl)sulfonylmethyl]phenol
Also Known As: 2-Propanone,1-mercapto-3-phenyl, 2,4-dichloro-6-[(2,4,6-trimethylphenyl)sulfonylmethyl]phenol, 2,4-dichloro-6-{[(2,4,6-trimethylphenyl)sulfonyl]methyl}phenol, 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol, Phenol,2,4-dichloro-6-[[(2,4,6-trimethylphenyl)sulfonyl]methyl]-
| Molecular Formula | C16H16Cl2O3S |
|---|---|
| Molecular Weight | 358.02 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.0197 |
| Heavy Atoms | 22 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 64181-84-6 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)CC2=C(C(=CC(=C2)Cl)Cl)O)C |
| InChIKey | HNQCNXWWWLSZKI-UHFFFAOYSA-N |
Product Overview
2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol (CAS 64181-84-6), with molecular formula C16H16Cl2O3S and molecular weight 358.02 g/mol. IUPAC: 2,4-dichloro-6-[(2,4,6-trimethylphenyl)sulfonylmethyl]phenol.
Chemical Property Profile of 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol
Property Insights of 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol
The XLogP value of 4.6 indicates that 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol. Following Lipinski's Rule of Five, 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol has 1 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-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol?
The CAS number of 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol is 64181-84-6.
What is the molecular formula of 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol?
The molecular formula of 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol is C16H16Cl2O3S.
What is the molecular weight of 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol?
The molecular weight of 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol is 358.02 g/mol.
Where can I buy 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol?
You can request a quote for 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-6-[(2,4,6-trimethylbenzene-1-sulfonyl)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.