1-Methyl-3-(4-methylbenzyl)benzene
TL;DR: 1-Methyl-3-(4-methylbenzyl)benzene (CAS 21895-16-9) is a chemical compound with molecular formula C15H16 and molecular weight 196.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-[(4-methylphenyl)methyl]benzene
Also Known As: 1-Methyl-3-(4-methylbenzyl)benzene, m-Tolyl-p-tolyl-methan, m-Tolyl(p-tolyl)methane, Methane, m-tolyl-p-tolyl-, 3,4'-Dimethyldiphenylmethane
| Molecular Formula | C15H16 |
|---|---|
| Molecular Weight | 196.13 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.1252 |
| Heavy Atoms | 15 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 21895-16-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC2=CC=CC(=C2)C |
| InChIKey | DEGFPRMMRHFIBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-3-(4-methylbenzyl)benzene (CAS 21895-16-9), with molecular formula C15H16 and molecular weight 196.13 g/mol. IUPAC: 1-methyl-3-[(4-methylphenyl)methyl]benzene.
Chemical Property Profile of 1-Methyl-3-(4-methylbenzyl)benzene
Property Insights of 1-Methyl-3-(4-methylbenzyl)benzene
The XLogP value of 4.6 indicates that 1-Methyl-3-(4-methylbenzyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Methyl-3-(4-methylbenzyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-(4-methylbenzyl)benzene has 0 hydrogen bond donor(s) and 0 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 1-Methyl-3-(4-methylbenzyl)benzene?
The CAS number of 1-Methyl-3-(4-methylbenzyl)benzene is 21895-16-9.
What is the molecular formula of 1-Methyl-3-(4-methylbenzyl)benzene?
The molecular formula of 1-Methyl-3-(4-methylbenzyl)benzene is C15H16.
What is the molecular weight of 1-Methyl-3-(4-methylbenzyl)benzene?
The molecular weight of 1-Methyl-3-(4-methylbenzyl)benzene is 196.13 g/mol.
Where can I buy 1-Methyl-3-(4-methylbenzyl)benzene?
You can request a quote for 1-Methyl-3-(4-methylbenzyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-(4-methylbenzyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-(4-methylbenzyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.