![1-[4-(Hexylsulfanyl)phenyl]ethanone structure](/static/products/935/93570-39-9.png)
1-[4-(Hexylsulfanyl)phenyl]ethanone
TL;DR: 1-[4-(Hexylsulfanyl)phenyl]ethanone (CAS 93570-39-9) is a chemical compound with molecular formula C14H20OS and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-hexylsulfanylphenyl)ethanone
Also Known As: 1-[4-(hexylsulfanyl)phenyl]ethanone, 1-(4-hexylsulfanylphenyl)ethanone, 1-acetyl-4-hexylthiobenzene, 1-[4-(hexylsulfanyl)phenyl]ethan-1-one, 1-(4-(Hexylthio)phenyl)ethan-1-one
| Molecular Formula | C14H20OS |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 4.5616 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.12349 |
| Heavy Atoms | 16 |
| Complexity | 316.01215 |
Chemical Identifiers
| CAS Number | 93570-39-9 |
|---|---|
| SMILES | CCCCCCSC1=CC=C(C=C1)C(=O)C |
Product Overview
1-[4-(Hexylsulfanyl)phenyl]ethanone (CAS 93570-39-9), with molecular formula C14H20OS and molecular weight 236.12 g/mol. IUPAC: 1-(4-hexylsulfanylphenyl)ethanone.
Chemical Property Profile of 1-[4-(Hexylsulfanyl)phenyl]ethanone
Property Insights of 1-[4-(Hexylsulfanyl)phenyl]ethanone
The XLogP value of 4.5616 indicates that 1-[4-(Hexylsulfanyl)phenyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-[4-(Hexylsulfanyl)phenyl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(Hexylsulfanyl)phenyl]ethanone has 0 hydrogen bond donor(s) and 2 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 1-[4-(Hexylsulfanyl)phenyl]ethanone?
The CAS number of 1-[4-(Hexylsulfanyl)phenyl]ethanone is 93570-39-9.
What is the molecular formula of 1-[4-(Hexylsulfanyl)phenyl]ethanone?
The molecular formula of 1-[4-(Hexylsulfanyl)phenyl]ethanone is C14H20OS.
What is the molecular weight of 1-[4-(Hexylsulfanyl)phenyl]ethanone?
The molecular weight of 1-[4-(Hexylsulfanyl)phenyl]ethanone is 236.12 g/mol.
Where can I buy 1-[4-(Hexylsulfanyl)phenyl]ethanone?
You can request a quote for 1-[4-(Hexylsulfanyl)phenyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(Hexylsulfanyl)phenyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Hexylsulfanyl)phenyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.