4-Fluorobenzyl phenyl sulfide
TL;DR: 4-Fluorobenzyl phenyl sulfide (CAS 351-66-6) is a chemical compound with molecular formula C13H11FS and molecular weight 218.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-4-(phenylsulfanylmethyl)benzene
Also Known As: 4-Fluorobenzyl phenyl sulfide, 1-fluoro-4-(phenylsulfanylmethyl)benzene, (4-Fluorobenzyl)(phenyl)sulfane, 4-Fluorobenzyl phenyl sulphide, 4-Fluorobenzylphenyl sulfide
| Molecular Formula | C13H11FS |
|---|---|
| Molecular Weight | 218.06 g/mol |
| LogP | 4.118 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.05655 |
| Heavy Atoms | 15 |
| Complexity | 408.3109 |
Chemical Identifiers
| CAS Number | 351-66-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC2=CC=C(C=C2)F |
Product Overview
4-Fluorobenzyl phenyl sulfide (CAS 351-66-6), with molecular formula C13H11FS and molecular weight 218.06 g/mol. IUPAC: 1-fluoro-4-(phenylsulfanylmethyl)benzene.
Chemical Property Profile of 4-Fluorobenzyl phenyl sulfide
Property Insights of 4-Fluorobenzyl phenyl sulfide
The XLogP value of 4.118 indicates that 4-Fluorobenzyl phenyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Fluorobenzyl phenyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorobenzyl phenyl sulfide has 0 hydrogen bond donor(s) and 1 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 4-Fluorobenzyl phenyl sulfide?
The CAS number of 4-Fluorobenzyl phenyl sulfide is 351-66-6.
What is the molecular formula of 4-Fluorobenzyl phenyl sulfide?
The molecular formula of 4-Fluorobenzyl phenyl sulfide is C13H11FS.
What is the molecular weight of 4-Fluorobenzyl phenyl sulfide?
The molecular weight of 4-Fluorobenzyl phenyl sulfide is 218.06 g/mol.
Where can I buy 4-Fluorobenzyl phenyl sulfide?
You can request a quote for 4-Fluorobenzyl phenyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorobenzyl phenyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorobenzyl phenyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.