Benzene, 1-methyl-4-((1-methylethyl)thio)-
TL;DR: Benzene, 1-methyl-4-((1-methylethyl)thio)- (CAS 14905-81-8) is a chemical compound with molecular formula C10H14S and molecular weight 166.08162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-4-propan-2-ylsulfanylbenzene
Also Known As: Isopropyl 4-methylphenyl sulfide, Isopropyl p-tolyl sulfide, Sulfide, isopropyl p-tolyl, Isopropyl-p-tolyl-sulfid, Isopropyl p-cresyl sulfide
Technical Specifications
| Molecular Formula | C10H14S |
| Molecular Weight | 166.08162 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.08162 Da |
| Heavy Atoms | 11 |
| Complexity | 101.0 |
| SMILES | CC1=CC=C(C=C1)SC(C)C |
| InChIKey | LXDBBXHXMUZFBP-UHFFFAOYSA-N |
Chemical Property Profile of Benzene, 1-methyl-4-((1-methylethyl)thio)-
Property Insights of Benzene, 1-methyl-4-((1-methylethyl)thio)-
The XLogP value of 3.6 indicates that Benzene, 1-methyl-4-((1-methylethyl)thio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Benzene, 1-methyl-4-((1-methylethyl)thio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-methyl-4-((1-methylethyl)thio)- 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
What is the CAS number of Benzene, 1-methyl-4-((1-methylethyl)thio)-?
The CAS number of Benzene, 1-methyl-4-((1-methylethyl)thio)- is 14905-81-8.
What is the molecular formula of Benzene, 1-methyl-4-((1-methylethyl)thio)-?
The molecular formula of Benzene, 1-methyl-4-((1-methylethyl)thio)- is C10H14S.
What is the molecular weight of Benzene, 1-methyl-4-((1-methylethyl)thio)-?
The molecular weight of Benzene, 1-methyl-4-((1-methylethyl)thio)- is 166.08162 g/mol.
Where can I buy Benzene, 1-methyl-4-((1-methylethyl)thio)-?
You can request a quote for Benzene, 1-methyl-4-((1-methylethyl)thio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzene, 1-methyl-4-((1-methylethyl)thio)-?
Yes, CoreyChem provides custom synthesis services for Benzene, 1-methyl-4-((1-methylethyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.