Ethyl phenylsulfanylformate
TL;DR: Ethyl phenylsulfanylformate (CAS 5201-46-7) is a chemical compound with molecular formula C9H10O2S and molecular weight 182.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl phenylsulfanylformate
Also Known As: ethyl phenylsulfanylformate, carboethoxy phenyl sulfide, O-Ethyl S-phenyl thiocarbonate, O-Ethyl S-phenyl carbonothioate, ETHYL (PHENYLSULFANYL)FORMATE
| Molecular Formula | C9H10O2S |
|---|---|
| Molecular Weight | 182.04 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 182.04015 |
| Heavy Atoms | 12 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 5201-46-7 |
|---|---|
| SMILES | CCOC(=O)SC1=CC=CC=C1 |
| InChIKey | GRTYZPWCIXYJJR-UHFFFAOYSA-N |
Product Overview
Ethyl phenylsulfanylformate (CAS 5201-46-7), with molecular formula C9H10O2S and molecular weight 182.04 g/mol. IUPAC: ethyl phenylsulfanylformate.
Chemical Property Profile of Ethyl phenylsulfanylformate
Property Insights of Ethyl phenylsulfanylformate
The XLogP value of 3.0 indicates that Ethyl phenylsulfanylformate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.6 Ų, Ethyl phenylsulfanylformate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl phenylsulfanylformate 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 phenylsulfanylformate?
The CAS number of Ethyl phenylsulfanylformate is 5201-46-7.
What is the molecular formula of Ethyl phenylsulfanylformate?
The molecular formula of Ethyl phenylsulfanylformate is C9H10O2S.
What is the molecular weight of Ethyl phenylsulfanylformate?
The molecular weight of Ethyl phenylsulfanylformate is 182.04 g/mol.
Where can I buy Ethyl phenylsulfanylformate?
You can request a quote for Ethyl phenylsulfanylformate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl phenylsulfanylformate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl phenylsulfanylformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.