Benzene, 1-methyl-2-(4-methylphenoxy)-
TL;DR: Benzene, 1-methyl-2-(4-methylphenoxy)- (CAS 3402-72-0) is a chemical compound with molecular formula C14H14O and molecular weight 198.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-2-(4-methylphenoxy)benzene
Also Known As: Ether, o-tolyl p-tolyl, 1-Methyl-2-(4-methylphenoxy)benzene, Benzene, 1-methyl-2-(4-methylphenoxy)-, o-Tolyl p-tolyl ether, 4-(2-Methylphenoxy)toluene
| Molecular Formula | C14H14O |
|---|---|
| Molecular Weight | 198.10 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.10446 |
| Heavy Atoms | 15 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 3402-72-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC2=CC=CC=C2C |
| InChIKey | WJPVFWSONCRYGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-methyl-2-(4-methylphenoxy)- (CAS 3402-72-0), with molecular formula C14H14O and molecular weight 198.10 g/mol. IUPAC: 1-methyl-2-(4-methylphenoxy)benzene.
Chemical Property Profile of Benzene, 1-methyl-2-(4-methylphenoxy)-
Property Insights of Benzene, 1-methyl-2-(4-methylphenoxy)-
The XLogP value of 4.7 indicates that Benzene, 1-methyl-2-(4-methylphenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Benzene, 1-methyl-2-(4-methylphenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-methyl-2-(4-methylphenoxy)- 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 Benzene, 1-methyl-2-(4-methylphenoxy)-?
The CAS number of Benzene, 1-methyl-2-(4-methylphenoxy)- is 3402-72-0.
What is the molecular formula of Benzene, 1-methyl-2-(4-methylphenoxy)-?
The molecular formula of Benzene, 1-methyl-2-(4-methylphenoxy)- is C14H14O.
What is the molecular weight of Benzene, 1-methyl-2-(4-methylphenoxy)-?
The molecular weight of Benzene, 1-methyl-2-(4-methylphenoxy)- is 198.10 g/mol.
Where can I buy Benzene, 1-methyl-2-(4-methylphenoxy)-?
You can request a quote for Benzene, 1-methyl-2-(4-methylphenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-methyl-2-(4-methylphenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-methyl-2-(4-methylphenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.