2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate
TL;DR: 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate (CAS 71840-30-7) is a chemical compound with molecular formula C22H20O3 and molecular weight 332.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl] benzoate
Also Known As: 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate, 2-[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl benzoate, Phenol, 2-[[2-(benzoyloxy)-5-methylphenyl]methyl]-4-methyl-, 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate #, 2-[(2-Benzoyloxy-5-methylphenyl)methyl]-4-methylphenol
| Molecular Formula | C22H20O3 |
|---|---|
| Molecular Weight | 332.14 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.14124 |
| Heavy Atoms | 25 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 71840-30-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)CC2=C(C=CC(=C2)C)OC(=O)C3=CC=CC=C3 |
| InChIKey | YLFQFCDSIXPERU-UHFFFAOYSA-N |
Product Overview
2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate (CAS 71840-30-7), with molecular formula C22H20O3 and molecular weight 332.14 g/mol. IUPAC: [2-[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenyl] benzoate.
Chemical Property Profile of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate
Property Insights of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate
The XLogP value of 5.6 indicates that 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate?
The CAS number of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate is 71840-30-7.
What is the molecular formula of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate?
The molecular formula of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate is C22H20O3.
What is the molecular weight of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate?
The molecular weight of 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate is 332.14 g/mol.
Where can I buy 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate?
You can request a quote for 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Hydroxy-5-methylbenzyl)-4-methylphenyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.