Phenetole, beta-(ethylthio)-p-nitro-
TL;DR: Phenetole, beta-(ethylthio)-p-nitro- (CAS 22433-89-2) is a chemical compound with molecular formula C10H13NO3S and molecular weight 227.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethylsulfanylethoxy)-4-nitrobenzene
Also Known As: Synerphos, Phenetole, beta-(ethylthio)-p-nitro-, 1-[2-(ethylsulfanyl)ethoxy]-4-nitrobenzene, Benzene, 1-(2-(ethylthio)ethoxy)-4-nitro-, 1-(2-ethylsulfanylethoxy)-4-nitrobenzene
| Molecular Formula | C10H13NO3S |
|---|---|
| Molecular Weight | 227.06 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 80.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.06161 |
| Heavy Atoms | 15 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 22433-89-2 |
|---|---|
| SMILES | CCSCCOC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | QMZNCBRRQAZBJE-UHFFFAOYSA-N |
Product Overview
Phenetole, beta-(ethylthio)-p-nitro- (CAS 22433-89-2), with molecular formula C10H13NO3S and molecular weight 227.06 g/mol. IUPAC: 1-(2-ethylsulfanylethoxy)-4-nitrobenzene.
Chemical Property Profile of Phenetole, beta-(ethylthio)-p-nitro-
Property Insights of Phenetole, beta-(ethylthio)-p-nitro-
The XLogP value of 3.2 indicates that Phenetole, beta-(ethylthio)-p-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenetole, beta-(ethylthio)-p-nitro-. Following Lipinski's Rule of Five, Phenetole, beta-(ethylthio)-p-nitro- has 0 hydrogen bond donor(s) and 4 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 Phenetole, beta-(ethylthio)-p-nitro-?
The CAS number of Phenetole, beta-(ethylthio)-p-nitro- is 22433-89-2.
What is the molecular formula of Phenetole, beta-(ethylthio)-p-nitro-?
The molecular formula of Phenetole, beta-(ethylthio)-p-nitro- is C10H13NO3S.
What is the molecular weight of Phenetole, beta-(ethylthio)-p-nitro-?
The molecular weight of Phenetole, beta-(ethylthio)-p-nitro- is 227.06 g/mol.
Where can I buy Phenetole, beta-(ethylthio)-p-nitro-?
You can request a quote for Phenetole, beta-(ethylthio)-p-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenetole, beta-(ethylthio)-p-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Phenetole, beta-(ethylthio)-p-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.