Benzyl mesylate
TL;DR: Benzyl mesylate (CAS 55791-06-5) is a chemical compound with molecular formula C8H10O3S and molecular weight 186.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl methanesulfonate
Also Known As: benzyl methanesulfonate, benzyl mesylate, Phenylmethyl methanesulfonate, METHYLSULFONYLOXYMETHYLBENZENE, Methanesulfonic acid, phenylmethyl ester
| Molecular Formula | C8H10O3S |
|---|---|
| Molecular Weight | 186.04 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.03506 |
| Heavy Atoms | 12 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 55791-06-5 |
|---|---|
| SMILES | CS(=O)(=O)OCC1=CC=CC=C1 |
| InChIKey | ZDKRMIJRCHPKLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl mesylate (CAS 55791-06-5), with molecular formula C8H10O3S and molecular weight 186.04 g/mol. IUPAC: benzyl methanesulfonate.
Chemical Property Profile of Benzyl mesylate
Property Insights of Benzyl mesylate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl mesylate. With a topological polar surface area (TPSA) of 51.8 Ų, Benzyl mesylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl mesylate has 0 hydrogen bond donor(s) and 3 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 Benzyl mesylate?
The CAS number of Benzyl mesylate is 55791-06-5.
What is the molecular formula of Benzyl mesylate?
The molecular formula of Benzyl mesylate is C8H10O3S.
What is the molecular weight of Benzyl mesylate?
The molecular weight of Benzyl mesylate is 186.04 g/mol.
Where can I buy Benzyl mesylate?
You can request a quote for Benzyl mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl mesylate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.