Cyclohexylidenemethanesulfonylbenzene
TL;DR: Cyclohexylidenemethanesulfonylbenzene (CAS 90020-44-3) is a chemical compound with molecular formula C13H16O2S and molecular weight 236.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexylidenemethylsulfonylbenzene
Also Known As: Cyclohexylidenemethanesulfonylbenzene, cyclohexylidenemethylsulfonylbenzene, Cyclohexylmethyliden-phenylsulfon, (Phenylsulfonylmethylene)cyclohexane, (Cyclohexylidenemethyl)phenyl sulfone
| Molecular Formula | C13H16O2S |
|---|---|
| Molecular Weight | 236.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.0871 |
| Heavy Atoms | 16 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 90020-44-3 |
|---|---|
| SMILES | C1CCC(=CS(=O)(=O)C2=CC=CC=C2)CC1 |
| InChIKey | DWBHPXYXLLTGQQ-UHFFFAOYSA-N |
Product Overview
Cyclohexylidenemethanesulfonylbenzene (CAS 90020-44-3), with molecular formula C13H16O2S and molecular weight 236.09 g/mol. IUPAC: cyclohexylidenemethylsulfonylbenzene.
Chemical Property Profile of Cyclohexylidenemethanesulfonylbenzene
Property Insights of Cyclohexylidenemethanesulfonylbenzene
The XLogP value of 3.1 indicates that Cyclohexylidenemethanesulfonylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, Cyclohexylidenemethanesulfonylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexylidenemethanesulfonylbenzene 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 Cyclohexylidenemethanesulfonylbenzene?
The CAS number of Cyclohexylidenemethanesulfonylbenzene is 90020-44-3.
What is the molecular formula of Cyclohexylidenemethanesulfonylbenzene?
The molecular formula of Cyclohexylidenemethanesulfonylbenzene is C13H16O2S.
What is the molecular weight of Cyclohexylidenemethanesulfonylbenzene?
The molecular weight of Cyclohexylidenemethanesulfonylbenzene is 236.09 g/mol.
Where can I buy Cyclohexylidenemethanesulfonylbenzene?
You can request a quote for Cyclohexylidenemethanesulfonylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexylidenemethanesulfonylbenzene?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexylidenemethanesulfonylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.