Propyl P-tolyl sulfide
TL;DR: Propyl P-tolyl sulfide (CAS 24599-52-8) is a chemical compound with molecular formula C10H14S and molecular weight 166.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-propylsulfanylbenzene
Also Known As: Propyl p-tolyl sulfide, Propyl(p-tolyl)sulfane, Sulfide, propyl p-tolyl, 1-methyl-4-propylsulfanylbenzene, Propyl(4-methylphenyl) sulfide
| Molecular Formula | C10H14S |
|---|---|
| Molecular Weight | 166.08 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.08162 |
| Heavy Atoms | 11 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 24599-52-8 |
|---|---|
| SMILES | CCCSC1=CC=C(C=C1)C |
| InChIKey | IXOMJZNGYMCDGN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propyl P-tolyl sulfide (CAS 24599-52-8), with molecular formula C10H14S and molecular weight 166.08 g/mol. IUPAC: 1-methyl-4-propylsulfanylbenzene.
Chemical Property Profile of Propyl P-tolyl sulfide
Property Insights of Propyl P-tolyl sulfide
The XLogP value of 3.7 indicates that Propyl P-tolyl 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, Propyl P-tolyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl P-tolyl 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 Propyl P-tolyl sulfide?
The CAS number of Propyl P-tolyl sulfide is 24599-52-8.
What is the molecular formula of Propyl P-tolyl sulfide?
The molecular formula of Propyl P-tolyl sulfide is C10H14S.
What is the molecular weight of Propyl P-tolyl sulfide?
The molecular weight of Propyl P-tolyl sulfide is 166.08 g/mol.
Where can I buy Propyl P-tolyl sulfide?
You can request a quote for Propyl P-tolyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl P-tolyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for Propyl P-tolyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.