1-(Cyclohexylsulfonyl)-4-methylbenzene
TL;DR: 1-(Cyclohexylsulfonyl)-4-methylbenzene (CAS 68201-83-2) is a chemical compound with molecular formula C13H18O2S and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexylsulfonyl-4-methylbenzene
Also Known As: 1-(cyclohexylsulfonyl)-4-methylbenzene, NCIOpen2_007004, 2-(4-tolylsulfonyl)cyclohexane, Cyclohexyl(4-methylphenyl) sulfone, KST-1B7413
| Molecular Formula | C13H18O2S |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.10275 |
| Heavy Atoms | 16 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 68201-83-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2CCCCC2 |
| InChIKey | IBSAIUWYTSMHMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Cyclohexylsulfonyl)-4-methylbenzene (CAS 68201-83-2), with molecular formula C13H18O2S and molecular weight 238.10 g/mol. IUPAC: 1-cyclohexylsulfonyl-4-methylbenzene.
Chemical Property Profile of 1-(Cyclohexylsulfonyl)-4-methylbenzene
Property Insights of 1-(Cyclohexylsulfonyl)-4-methylbenzene
The XLogP value of 3.3 indicates that 1-(Cyclohexylsulfonyl)-4-methylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 1-(Cyclohexylsulfonyl)-4-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Cyclohexylsulfonyl)-4-methylbenzene 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-(Cyclohexylsulfonyl)-4-methylbenzene?
The CAS number of 1-(Cyclohexylsulfonyl)-4-methylbenzene is 68201-83-2.
What is the molecular formula of 1-(Cyclohexylsulfonyl)-4-methylbenzene?
The molecular formula of 1-(Cyclohexylsulfonyl)-4-methylbenzene is C13H18O2S.
What is the molecular weight of 1-(Cyclohexylsulfonyl)-4-methylbenzene?
The molecular weight of 1-(Cyclohexylsulfonyl)-4-methylbenzene is 238.10 g/mol.
Where can I buy 1-(Cyclohexylsulfonyl)-4-methylbenzene?
You can request a quote for 1-(Cyclohexylsulfonyl)-4-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Cyclohexylsulfonyl)-4-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Cyclohexylsulfonyl)-4-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.