Methyl 1-phenylethanesulfonate
TL;DR: Methyl 1-phenylethanesulfonate (CAS 883835-57-2) is a chemical compound with molecular formula C9H12O3S and molecular weight 200.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-phenylethanesulfonate
Also Known As: methyl 1-phenylethanesulfonate, Cefadroxil Impurity 25, Cephalexin Impurity33, Cefprozil Impurity 09, 1-methoxysulfonylethylbenzene
| Molecular Formula | C9H12O3S |
|---|---|
| Molecular Weight | 200.05 g/mol |
| LogP | 1.7238 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.05072 |
| Heavy Atoms | 13 |
| Complexity | 355.70602 |
Chemical Identifiers
| CAS Number | 883835-57-2 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)S(=O)(=O)OC |
Product Overview
Methyl 1-phenylethanesulfonate (CAS 883835-57-2), with molecular formula C9H12O3S and molecular weight 200.05 g/mol. IUPAC: methyl 1-phenylethanesulfonate.
Chemical Property Profile of Methyl 1-phenylethanesulfonate
Property Insights of Methyl 1-phenylethanesulfonate
The XLogP value of 1.7238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-phenylethanesulfonate. With a topological polar surface area (TPSA) of 43.37 Ų, Methyl 1-phenylethanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-phenylethanesulfonate 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 Methyl 1-phenylethanesulfonate?
The CAS number of Methyl 1-phenylethanesulfonate is 883835-57-2.
What is the molecular formula of Methyl 1-phenylethanesulfonate?
The molecular formula of Methyl 1-phenylethanesulfonate is C9H12O3S.
What is the molecular weight of Methyl 1-phenylethanesulfonate?
The molecular weight of Methyl 1-phenylethanesulfonate is 200.05 g/mol.
Where can I buy Methyl 1-phenylethanesulfonate?
You can request a quote for Methyl 1-phenylethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-phenylethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-phenylethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.