3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid
TL;DR: 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid (CAS 63021-00-1) is a chemical compound with molecular formula C16H18O3 and molecular weight 258.12558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(6-methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid
Also Known As: 3-(6-methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid, Dimethyl ethyl allenolic acid methyl ether, Acide dimethyl-ethyl-allenolique ether methylique, C-702, 3-10-00-01123 (Beilstein Handbook Reference)
Technical Specifications
| Molecular Formula | C16H18O3 |
| Molecular Weight | 258.12558 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.12558 Da |
| Heavy Atoms | 19 |
| Complexity | 324.0 |
| SMILES | CC(C)(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O |
| InChIKey | SMKLZXIWNMEXSQ-UHFFFAOYSA-N |
Chemical Property Profile of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid
Property Insights of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid
The XLogP value of 3.9 indicates that 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic 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
What is the CAS number of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid?
The CAS number of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid is 63021-00-1.
What is the molecular formula of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid?
The molecular formula of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid is C16H18O3.
What is the molecular weight of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid?
The molecular weight of 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid is 258.12558 g/mol.
Where can I buy 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid?
You can request a quote for 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid?
Yes, CoreyChem provides custom synthesis services for 3-(6-Methoxynaphthalen-2-yl)-2,2-dimethylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.