Alpha,alpha-dimethylbenzyl phenyl sulfide
TL;DR: Alpha,alpha-dimethylbenzyl phenyl sulfide (CAS 4148-93-0) is a chemical compound with molecular formula C15H16S and molecular weight 228.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylpropan-2-ylsulfanylbenzene
Also Known As: starbld0008589, 2-phenyl-2-phenylthiopropane, Phenyl 2-phenylisopropyl sulfide, Phenyl(2-phenylpropan-2-yl)sulfane, 2-phenylpropan-2-ylsulfanylbenzene
| Molecular Formula | C15H16S |
|---|---|
| Molecular Weight | 228.10 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.09727 |
| Heavy Atoms | 16 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 4148-93-0 |
|---|---|
| SMILES | CC(C)(C1=CC=CC=C1)SC2=CC=CC=C2 |
| InChIKey | ZOABXTJWWVGXAM-UHFFFAOYSA-N |
Product Overview
Alpha,alpha-dimethylbenzyl phenyl sulfide (CAS 4148-93-0), with molecular formula C15H16S and molecular weight 228.10 g/mol. IUPAC: 2-phenylpropan-2-ylsulfanylbenzene.
Chemical Property Profile of Alpha,alpha-dimethylbenzyl phenyl sulfide
Property Insights of Alpha,alpha-dimethylbenzyl phenyl sulfide
The XLogP value of 4.5 indicates that Alpha,alpha-dimethylbenzyl phenyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Alpha,alpha-dimethylbenzyl phenyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alpha,alpha-dimethylbenzyl 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 Alpha,alpha-dimethylbenzyl phenyl sulfide?
The CAS number of Alpha,alpha-dimethylbenzyl phenyl sulfide is 4148-93-0.
What is the molecular formula of Alpha,alpha-dimethylbenzyl phenyl sulfide?
The molecular formula of Alpha,alpha-dimethylbenzyl phenyl sulfide is C15H16S.
What is the molecular weight of Alpha,alpha-dimethylbenzyl phenyl sulfide?
The molecular weight of Alpha,alpha-dimethylbenzyl phenyl sulfide is 228.10 g/mol.
Where can I buy Alpha,alpha-dimethylbenzyl phenyl sulfide?
You can request a quote for Alpha,alpha-dimethylbenzyl phenyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alpha,alpha-dimethylbenzyl phenyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for Alpha,alpha-dimethylbenzyl phenyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.