3-Fluorobenzoic acid, 2-naphthyl ester
TL;DR: 3-Fluorobenzoic acid, 2-naphthyl ester (CAS 791795-85-2) is a chemical compound with molecular formula C17H11FO2 and molecular weight 266.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-2-yl 3-fluorobenzoate
Also Known As: 2-naphthyl 3-fluorobenzoate, naphthalen-2-yl 3-fluorobenzoate, 3-Fluorobenzoic acid, 2-naphthyl ester, AN-652/11903666
| Molecular Formula | C17H11FO2 |
|---|---|
| Molecular Weight | 266.07 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.0743 |
| Heavy Atoms | 20 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 791795-85-2 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)OC(=O)C3=CC(=CC=C3)F |
| InChIKey | DMZDUEUTNJUCQS-UHFFFAOYSA-N |
Product Overview
3-Fluorobenzoic acid, 2-naphthyl ester (CAS 791795-85-2), with molecular formula C17H11FO2 and molecular weight 266.07 g/mol. IUPAC: naphthalen-2-yl 3-fluorobenzoate.
Chemical Property Profile of 3-Fluorobenzoic acid, 2-naphthyl ester
Property Insights of 3-Fluorobenzoic acid, 2-naphthyl ester
The XLogP value of 4.7 indicates that 3-Fluorobenzoic 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, 3-Fluorobenzoic acid, 2-naphthyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluorobenzoic acid, 2-naphthyl ester has 0 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 3-Fluorobenzoic acid, 2-naphthyl ester?
The CAS number of 3-Fluorobenzoic acid, 2-naphthyl ester is 791795-85-2.
What is the molecular formula of 3-Fluorobenzoic acid, 2-naphthyl ester?
The molecular formula of 3-Fluorobenzoic acid, 2-naphthyl ester is C17H11FO2.
What is the molecular weight of 3-Fluorobenzoic acid, 2-naphthyl ester?
The molecular weight of 3-Fluorobenzoic acid, 2-naphthyl ester is 266.07 g/mol.
Where can I buy 3-Fluorobenzoic acid, 2-naphthyl ester?
You can request a quote for 3-Fluorobenzoic 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 3-Fluorobenzoic acid, 2-naphthyl ester?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluorobenzoic acid, 2-naphthyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.