Mesitylmethyl phenyl sulfoxide
TL;DR: Mesitylmethyl phenyl sulfoxide (CAS 56010-71-0) is a chemical compound with molecular formula C16H18OS and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfinylmethyl)-1,3,5-trimethylbenzene
Also Known As: mesitylmethyl phenyl sulfoxide, 2-(benzenesulfinylmethyl)-1,3,5-trimethylbenzene, AB-131/42301690
| Molecular Formula | C16H18OS |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | 3.91966 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.10785 |
| Heavy Atoms | 18 |
| Complexity | 549.9009 |
Chemical Identifiers
| CAS Number | 56010-71-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)CS(=O)C2=CC=CC=C2)C |
Product Overview
Mesitylmethyl phenyl sulfoxide (CAS 56010-71-0), with molecular formula C16H18OS and molecular weight 258.11 g/mol. IUPAC: 2-(benzenesulfinylmethyl)-1,3,5-trimethylbenzene.
Chemical Property Profile of Mesitylmethyl phenyl sulfoxide
Property Insights of Mesitylmethyl phenyl sulfoxide
The XLogP value of 3.91966 indicates that Mesitylmethyl phenyl sulfoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, Mesitylmethyl phenyl sulfoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mesitylmethyl phenyl sulfoxide has 0 hydrogen bond donor(s) and 1 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 Mesitylmethyl phenyl sulfoxide?
The CAS number of Mesitylmethyl phenyl sulfoxide is 56010-71-0.
What is the molecular formula of Mesitylmethyl phenyl sulfoxide?
The molecular formula of Mesitylmethyl phenyl sulfoxide is C16H18OS.
What is the molecular weight of Mesitylmethyl phenyl sulfoxide?
The molecular weight of Mesitylmethyl phenyl sulfoxide is 258.11 g/mol.
Where can I buy Mesitylmethyl phenyl sulfoxide?
You can request a quote for Mesitylmethyl phenyl sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mesitylmethyl phenyl sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for Mesitylmethyl phenyl sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.