2-Naphthyl benzoate
TL;DR: 2-Naphthyl benzoate (CAS 93-44-7) is a chemical compound with molecular formula C17H12O2 and molecular weight 248.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-2-yl benzoate
Also Known As: 2-Naphthyl benzoate, naphthalen-2-yl benzoate, Benzonaphthol, Betabenzon, lintrin
| Molecular Formula | C17H12O2 |
|---|---|
| Molecular Weight | 248.08 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.08372 |
| Heavy Atoms | 19 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 93-44-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC3=CC=CC=C3C=C2 |
| InChIKey | DWJIJRSTYFPKGD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Naphthyl benzoate (CAS 93-44-7), with molecular formula C17H12O2 and molecular weight 248.08 g/mol. IUPAC: naphthalen-2-yl benzoate.
Chemical Property Profile of 2-Naphthyl benzoate
Property Insights of 2-Naphthyl benzoate
The XLogP value of 4.4 indicates that 2-Naphthyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Naphthyl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthyl benzoate has 0 hydrogen bond donor(s) and 2 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 2-Naphthyl benzoate?
The CAS number of 2-Naphthyl benzoate is 93-44-7.
What is the molecular formula of 2-Naphthyl benzoate?
The molecular formula of 2-Naphthyl benzoate is C17H12O2.
What is the molecular weight of 2-Naphthyl benzoate?
The molecular weight of 2-Naphthyl benzoate is 248.08 g/mol.
Where can I buy 2-Naphthyl benzoate?
You can request a quote for 2-Naphthyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.