1,2-Dichlorovinyl4-methylphenylsulfone
TL;DR: 1,2-Dichlorovinyl4-methylphenylsulfone (CAS 82440-65-1) is a chemical compound with molecular formula C9H8Cl2O2S and molecular weight 249.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-1,2-dichloroethenyl]sulfonyl-4-methylbenzene
Also Known As: 1,2-dichlorovinyl4-methylphenylsulfone, 1-[(E)-1,2-dichloroethenyl]sulfonyl-4-methylbenzene, AB-131/42300844, (E)-1-((1,2-Dichlorovinyl)sulfonyl)-4-methylbenzene, (1E)-1,2-dichloro-1-[(4-methylphenyl)sulfonyl]ethene
| Molecular Formula | C9H8Cl2O2S |
|---|---|
| Molecular Weight | 249.96 g/mol |
| LogP | 3.04522 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.9622 |
| Heavy Atoms | 14 |
| Complexity | 446.20523 |
Chemical Identifiers
| CAS Number | 82440-65-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)/C(=C\Cl)/Cl |
Product Overview
1,2-Dichlorovinyl4-methylphenylsulfone (CAS 82440-65-1), with molecular formula C9H8Cl2O2S and molecular weight 249.96 g/mol. IUPAC: 1-[(E)-1,2-dichloroethenyl]sulfonyl-4-methylbenzene.
Chemical Property Profile of 1,2-Dichlorovinyl4-methylphenylsulfone
Property Insights of 1,2-Dichlorovinyl4-methylphenylsulfone
The XLogP value of 3.04522 indicates that 1,2-Dichlorovinyl4-methylphenylsulfone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 1,2-Dichlorovinyl4-methylphenylsulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dichlorovinyl4-methylphenylsulfone has 0 hydrogen bond donor(s) and 2 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 1,2-Dichlorovinyl4-methylphenylsulfone?
The CAS number of 1,2-Dichlorovinyl4-methylphenylsulfone is 82440-65-1.
What is the molecular formula of 1,2-Dichlorovinyl4-methylphenylsulfone?
The molecular formula of 1,2-Dichlorovinyl4-methylphenylsulfone is C9H8Cl2O2S.
What is the molecular weight of 1,2-Dichlorovinyl4-methylphenylsulfone?
The molecular weight of 1,2-Dichlorovinyl4-methylphenylsulfone is 249.96 g/mol.
Where can I buy 1,2-Dichlorovinyl4-methylphenylsulfone?
You can request a quote for 1,2-Dichlorovinyl4-methylphenylsulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dichlorovinyl4-methylphenylsulfone?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dichlorovinyl4-methylphenylsulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.