3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid
TL;DR: 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid (CAS 86785-12-8) is a chemical compound with molecular formula C19H14O3 and molecular weight 290.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-(naphthalene-1-carbonyl)benzoic acid
Also Known As: 2-(1-Naphthoyl)-3-methylbenzoic acid, 3-Methyl-2-(1-naphthoyl)benzoic acid, 3-methyl-2-(naphthalene-1-carbonyl)benzoic acid, NCI60_007982, Benzoic acid, 3-methyl-2-(1-naphthalenylcarbonyl)-
| Molecular Formula | C19H14O3 |
|---|---|
| Molecular Weight | 290.09 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.0943 |
| Heavy Atoms | 22 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 86785-12-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)O)C(=O)C2=CC=CC3=CC=CC=C32 |
| InChIKey | YTIODIXTUPNVSG-UHFFFAOYSA-N |
Product Overview
3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid (CAS 86785-12-8), with molecular formula C19H14O3 and molecular weight 290.09 g/mol. IUPAC: 3-methyl-2-(naphthalene-1-carbonyl)benzoic acid.
Chemical Property Profile of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid
Property Insights of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid
The XLogP value of 4.4 indicates that 3-Methyl-2-(naphthalene-1-carbonyl)benzoic 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, 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid 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
Frequently Asked Questions
What is the CAS number of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid?
The CAS number of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid is 86785-12-8.
What is the molecular formula of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid?
The molecular formula of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid is C19H14O3.
What is the molecular weight of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid?
The molecular weight of 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid is 290.09 g/mol.
Where can I buy 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid?
You can request a quote for 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2-(naphthalene-1-carbonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.