p-Chlorophenyl isopropyl sulfone
TL;DR: p-Chlorophenyl isopropyl sulfone (CAS 7205-83-6) is a chemical compound with molecular formula C9H11ClO2S and molecular weight 218.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-propan-2-ylsulfonylbenzene
Also Known As: p-Chlorophenyl isopropyl sulfone, 1-Chloro-4-(isopropylsulfonyl)benzene, 1-chloro-4-(propane-2-sulfonyl)benzene, 1-chloro-4-propan-2-ylsulfonylbenzene, p-Chlorophenylisopropylsulfone
| Molecular Formula | C9H11ClO2S |
|---|---|
| Molecular Weight | 218.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.01683 |
| Heavy Atoms | 13 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 7205-83-6 |
|---|---|
| SMILES | CC(C)S(=O)(=O)C1=CC=C(C=C1)Cl |
| InChIKey | ZKVPUWNTECRZSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Chlorophenyl isopropyl sulfone (CAS 7205-83-6), with molecular formula C9H11ClO2S and molecular weight 218.02 g/mol. IUPAC: 1-chloro-4-propan-2-ylsulfonylbenzene.
Chemical Property Profile of p-Chlorophenyl isopropyl sulfone
Property Insights of p-Chlorophenyl isopropyl sulfone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Chlorophenyl isopropyl sulfone. With a topological polar surface area (TPSA) of 42.5 Ų, p-Chlorophenyl isopropyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Chlorophenyl isopropyl sulfone 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 p-Chlorophenyl isopropyl sulfone?
The CAS number of p-Chlorophenyl isopropyl sulfone is 7205-83-6.
What is the molecular formula of p-Chlorophenyl isopropyl sulfone?
The molecular formula of p-Chlorophenyl isopropyl sulfone is C9H11ClO2S.
What is the molecular weight of p-Chlorophenyl isopropyl sulfone?
The molecular weight of p-Chlorophenyl isopropyl sulfone is 218.02 g/mol.
Where can I buy p-Chlorophenyl isopropyl sulfone?
You can request a quote for p-Chlorophenyl isopropyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Chlorophenyl isopropyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for p-Chlorophenyl isopropyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.