4-Hydroxy-3,5-dimethylphenyl benzoate
TL;DR: 4-Hydroxy-3,5-dimethylphenyl benzoate (CAS 19462-65-8) is a chemical compound with molecular formula C15H14O3 and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxy-3,5-dimethylphenyl) benzoate
Also Known As: 4-hydroxy-3,5-dimethylphenyl benzoate, 4-benzoyloxy-2,6-dimethylphenol, (4-hydroxy-3,5-dimethylphenyl) benzoate, 1,4-Benzenediol,2,6-dimethyl-, 4-benzoate
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.0943 |
| Heavy Atoms | 18 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 19462-65-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)C)OC(=O)C2=CC=CC=C2 |
| InChIKey | IAMGWSKZBAUVET-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-3,5-dimethylphenyl benzoate (CAS 19462-65-8), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: (4-hydroxy-3,5-dimethylphenyl) benzoate.
Chemical Property Profile of 4-Hydroxy-3,5-dimethylphenyl benzoate
Property Insights of 4-Hydroxy-3,5-dimethylphenyl benzoate
The XLogP value of 3.7 indicates that 4-Hydroxy-3,5-dimethylphenyl 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, 4-Hydroxy-3,5-dimethylphenyl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-3,5-dimethylphenyl benzoate has 1 hydrogen bond donor(s) and 3 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 4-Hydroxy-3,5-dimethylphenyl benzoate?
The CAS number of 4-Hydroxy-3,5-dimethylphenyl benzoate is 19462-65-8.
What is the molecular formula of 4-Hydroxy-3,5-dimethylphenyl benzoate?
The molecular formula of 4-Hydroxy-3,5-dimethylphenyl benzoate is C15H14O3.
What is the molecular weight of 4-Hydroxy-3,5-dimethylphenyl benzoate?
The molecular weight of 4-Hydroxy-3,5-dimethylphenyl benzoate is 242.09 g/mol.
Where can I buy 4-Hydroxy-3,5-dimethylphenyl benzoate?
You can request a quote for 4-Hydroxy-3,5-dimethylphenyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-3,5-dimethylphenyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-3,5-dimethylphenyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.