Ethyl phenyl(phenylsulfanyl)acetate
TL;DR: Ethyl phenyl(phenylsulfanyl)acetate (CAS 66693-10-5) is a chemical compound with molecular formula C16H16O2S and molecular weight 272.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-phenyl-2-phenylsulfanylacetate
Also Known As: ethyl phenyl(phenylsulfanyl)acetate, Ethyl 2-phenyl-2-(phenylthio)acetate, ethyl 2-phenyl-2-phenylsulfanylacetate, (Phenylthio)phenylacetic acid ethyl ester, J1.962.073E
| Molecular Formula | C16H16O2S |
|---|---|
| Molecular Weight | 272.09 g/mol |
| LogP | 4.0831 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.0871 |
| Heavy Atoms | 19 |
| Complexity | 510.78683 |
Chemical Identifiers
| CAS Number | 66693-10-5 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC=CC=C1)SC2=CC=CC=C2 |
Product Overview
Ethyl phenyl(phenylsulfanyl)acetate (CAS 66693-10-5), with molecular formula C16H16O2S and molecular weight 272.09 g/mol. IUPAC: ethyl 2-phenyl-2-phenylsulfanylacetate.
Chemical Property Profile of Ethyl phenyl(phenylsulfanyl)acetate
Property Insights of Ethyl phenyl(phenylsulfanyl)acetate
The XLogP value of 4.0831 indicates that Ethyl phenyl(phenylsulfanyl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl phenyl(phenylsulfanyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl phenyl(phenylsulfanyl)acetate 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 Ethyl phenyl(phenylsulfanyl)acetate?
The CAS number of Ethyl phenyl(phenylsulfanyl)acetate is 66693-10-5.
What is the molecular formula of Ethyl phenyl(phenylsulfanyl)acetate?
The molecular formula of Ethyl phenyl(phenylsulfanyl)acetate is C16H16O2S.
What is the molecular weight of Ethyl phenyl(phenylsulfanyl)acetate?
The molecular weight of Ethyl phenyl(phenylsulfanyl)acetate is 272.09 g/mol.
Where can I buy Ethyl phenyl(phenylsulfanyl)acetate?
You can request a quote for Ethyl phenyl(phenylsulfanyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl phenyl(phenylsulfanyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl phenyl(phenylsulfanyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.