3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid
TL;DR: 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid (CAS 13723-98-3) is a chemical compound with molecular formula C18H24O4 and molecular weight 304.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid
Also Known As: 2-Naphthalenepropionic acid, .beta.-ethyl-1,2,3,4-tetrahydro-6-, 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid, 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethyl-pentanoic Acid
| Molecular Formula | C18H24O4 |
|---|---|
| Molecular Weight | 304.17 g/mol |
| LogP | 3.5773 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.16745 |
| Heavy Atoms | 22 |
| Complexity | 588.75 |
Chemical Identifiers
| CAS Number | 13723-98-3 |
|---|---|
| SMILES | CCC(C1CCC2=C(C1=O)C=CC(=C2)OC)C(C)(C)C(=O)O |
Product Overview
3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid (CAS 13723-98-3), with molecular formula C18H24O4 and molecular weight 304.17 g/mol. IUPAC: 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid.
Chemical Property Profile of 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid
Property Insights of 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid
The XLogP value of 3.5773 indicates that 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid. Following Lipinski's Rule of Five, 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic 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-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid?
The CAS number of 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid is 13723-98-3.
What is the molecular formula of 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid?
The molecular formula of 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid is C18H24O4.
What is the molecular weight of 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid?
The molecular weight of 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid is 304.17 g/mol.
Where can I buy 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid?
You can request a quote for 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(6-methoxy-1-oxo-3,4-dihydro-2H-naphthalen-2-yl)-2,2-dimethylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.