4-Hydroxy-2-methylnaphthyl benzoate
TL;DR: 4-Hydroxy-2-methylnaphthyl benzoate (CAS 2211-28-1) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-hydroxy-2-methylnaphthalen-1-yl) benzoate
Also Known As: 4-Hydroxy-2-methylnaphthyl benzoate, 4-Hydroxy-2-methyl-1-naphthyl benzoate, 4-hydroxy-2-methylnaphthalen-1-yl benzoate, 1,4-Naphthalenediol,2-methyl-, 1-benzoate, (4-hydroxy-2-methylnaphthalen-1-yl) benzoate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H14O3 |
| Molecular Weight | 278.0943 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0943 Da |
| Heavy Atoms | 21 |
| Complexity | 361.0 |
| SMILES | CC1=C(C2=CC=CC=C2C(=C1)O)OC(=O)C3=CC=CC=C3 |
| InChIKey | IZDSOVHFCMEEEZ-UHFFFAOYSA-N |
Chemical Property Profile of 4-Hydroxy-2-methylnaphthyl benzoate
Property Insights of 4-Hydroxy-2-methylnaphthyl benzoate
The XLogP value of 4.6 indicates that 4-Hydroxy-2-methylnaphthyl 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-2-methylnaphthyl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-2-methylnaphthyl 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
What is the CAS number of 4-Hydroxy-2-methylnaphthyl benzoate?
The CAS number of 4-Hydroxy-2-methylnaphthyl benzoate is 2211-28-1.
What is the molecular formula of 4-Hydroxy-2-methylnaphthyl benzoate?
The molecular formula of 4-Hydroxy-2-methylnaphthyl benzoate is C18H14O3.
What is the molecular weight of 4-Hydroxy-2-methylnaphthyl benzoate?
The molecular weight of 4-Hydroxy-2-methylnaphthyl benzoate is 278.0943 g/mol.
Where can I buy 4-Hydroxy-2-methylnaphthyl benzoate?
You can request a quote for 4-Hydroxy-2-methylnaphthyl benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Hydroxy-2-methylnaphthyl benzoate?
Yes, CoreyChem provides custom synthesis services for 4-Hydroxy-2-methylnaphthyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.