4-Benzyl-2-methylphenol
TL;DR: 4-Benzyl-2-methylphenol (CAS 101328-75-0) is a chemical compound with molecular formula C14H14O and molecular weight 198.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-benzyl-2-methylphenol
Also Known As: 4-benzyl-2-methylphenol, 2-Methyl-4-(phenylmethyl)phenol; ., 2-Methyl-4-(phenylmethyl)phenol, 830-932-0
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H14O |
| Molecular Weight | 198.10446 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.10446 Da |
| Heavy Atoms | 15 |
| Complexity | 184.0 |
| SMILES | CC1=C(C=CC(=C1)CC2=CC=CC=C2)O |
| InChIKey | JPCITNVIXXYRQK-UHFFFAOYSA-N |
Chemical Property Profile of 4-Benzyl-2-methylphenol
Property Insights of 4-Benzyl-2-methylphenol
The XLogP value of 3.9 indicates that 4-Benzyl-2-methylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Benzyl-2-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyl-2-methylphenol has 1 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 4-Benzyl-2-methylphenol?
The CAS number of 4-Benzyl-2-methylphenol is 101328-75-0.
What is the molecular formula of 4-Benzyl-2-methylphenol?
The molecular formula of 4-Benzyl-2-methylphenol is C14H14O.
What is the molecular weight of 4-Benzyl-2-methylphenol?
The molecular weight of 4-Benzyl-2-methylphenol is 198.10446 g/mol.
Where can I buy 4-Benzyl-2-methylphenol?
You can request a quote for 4-Benzyl-2-methylphenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Benzyl-2-methylphenol?
Yes, CoreyChem provides custom synthesis services for 4-Benzyl-2-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.