2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid
TL;DR: 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid (CAS 35187-92-9) is a chemical compound with molecular formula C20H15FO3 and molecular weight 322.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid
Also Known As: 2-(4-fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid
| Molecular Formula | C20H15FO3 |
|---|---|
| Molecular Weight | 322.10 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.10052 |
| Heavy Atoms | 24 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 35187-92-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)C2=CC(=C(C3=CC=CC=C32)F)C)C(=O)O |
| InChIKey | TZIYGMZVCTYCDE-UHFFFAOYSA-N |
Product Overview
2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid (CAS 35187-92-9), with molecular formula C20H15FO3 and molecular weight 322.10 g/mol. IUPAC: 2-(4-fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid.
Chemical Property Profile of 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid
Property Insights of 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid
The XLogP value of 4.9 indicates that 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid has 1 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-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid?
The CAS number of 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid is 35187-92-9.
What is the molecular formula of 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid?
The molecular formula of 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid is C20H15FO3.
What is the molecular weight of 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid?
The molecular weight of 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid is 322.10 g/mol.
Where can I buy 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid?
You can request a quote for 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluoro-3-methylnaphthalene-1-carbonyl)-6-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.