2,6-Difluorobenzoic acid, 2-naphthyl ester
TL;DR: 2,6-Difluorobenzoic acid, 2-naphthyl ester (CAS 959079-93-7) is a chemical compound with molecular formula C17H10F2O2 and molecular weight 284.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-2-yl 2,6-difluorobenzoate
Also Known As: naphthalen-2-yl 2,6-difluorobenzoate, 2,6-Difluorobenzoic acid, 2-naphthyl ester, F3386-5781
| Molecular Formula | C17H10F2O2 |
|---|---|
| Molecular Weight | 284.06 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.06488 |
| Heavy Atoms | 21 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 959079-93-7 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)OC(=O)C3=C(C=CC=C3F)F |
| InChIKey | PMPDADBYVZJXAX-UHFFFAOYSA-N |
Product Overview
2,6-Difluorobenzoic acid, 2-naphthyl ester (CAS 959079-93-7), with molecular formula C17H10F2O2 and molecular weight 284.06 g/mol. IUPAC: naphthalen-2-yl 2,6-difluorobenzoate.
Chemical Property Profile of 2,6-Difluorobenzoic acid, 2-naphthyl ester
Property Insights of 2,6-Difluorobenzoic acid, 2-naphthyl ester
The XLogP value of 4.8 indicates that 2,6-Difluorobenzoic acid, 2-naphthyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,6-Difluorobenzoic acid, 2-naphthyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Difluorobenzoic acid, 2-naphthyl ester has 0 hydrogen bond donor(s) and 4 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 2,6-Difluorobenzoic acid, 2-naphthyl ester?
The CAS number of 2,6-Difluorobenzoic acid, 2-naphthyl ester is 959079-93-7.
What is the molecular formula of 2,6-Difluorobenzoic acid, 2-naphthyl ester?
The molecular formula of 2,6-Difluorobenzoic acid, 2-naphthyl ester is C17H10F2O2.
What is the molecular weight of 2,6-Difluorobenzoic acid, 2-naphthyl ester?
The molecular weight of 2,6-Difluorobenzoic acid, 2-naphthyl ester is 284.06 g/mol.
Where can I buy 2,6-Difluorobenzoic acid, 2-naphthyl ester?
You can request a quote for 2,6-Difluorobenzoic acid, 2-naphthyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Difluorobenzoic acid, 2-naphthyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Difluorobenzoic acid, 2-naphthyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.