2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid
TL;DR: 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid (CAS 858199-99-2) is a chemical compound with molecular formula C13H10O4 and molecular weight 230.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methoxynaphthalen-1-yl)-2-oxoacetic acid
Also Known As: 2-(2-methoxynaphthalen-1-yl)-2-oxoacetic acid, 2-Methoxy-1-naphthaleneglyoxylic acid, 2-(2-methoxy-1-naphthyl)-2-oxo-acetic acid
| Molecular Formula | C13H10O4 |
|---|---|
| Molecular Weight | 230.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.0579 |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 858199-99-2 |
|---|---|
| SMILES | COC1=C(C2=CC=CC=C2C=C1)C(=O)C(=O)O |
| InChIKey | NVCYSEMELQKFKQ-UHFFFAOYSA-N |
Product Overview
2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid (CAS 858199-99-2), with molecular formula C13H10O4 and molecular weight 230.06 g/mol. IUPAC: 2-(2-methoxynaphthalen-1-yl)-2-oxoacetic acid.
Chemical Property Profile of 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid
Property Insights of 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid. Following Lipinski's Rule of Five, 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic 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-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid?
The CAS number of 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid is 858199-99-2.
What is the molecular formula of 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid?
The molecular formula of 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid is C13H10O4.
What is the molecular weight of 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid?
The molecular weight of 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid is 230.06 g/mol.
Where can I buy 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid?
You can request a quote for 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methoxynaphthalen-1-yl)-2-oxoacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.