![Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate structure](/static/products/115/115414-91-0.webp)
Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate
TL;DR: Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate (CAS 115414-91-0) is a chemical compound with molecular formula C16H16O4 and molecular weight 272.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[5-(2-methoxy-2-oxoethyl)naphthalen-1-yl]acetate
Also Known As: 1,5-Naphthalenediacetic acid dimethyl ester, dimethyl 2,2'-naphthalene-1,5-diyldiacetate, dimethyl 2,2'-(naphthalene-1,5-diyl)diacetate, methyl 2-[5-(2-methoxy-2-oxoethyl)naphthalen-1-yl]acetate, methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate
Technical Specifications
| Molecular Formula | C16H16O4 |
| Molecular Weight | 272.10486 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.10486 Da |
| Heavy Atoms | 20 |
| Complexity | 318.0 |
| SMILES | COC(=O)CC1=C2C=CC=C(C2=CC=C1)CC(=O)OC |
| InChIKey | POTWPXVZHGLMTJ-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate
Property Insights of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate?
The CAS number of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate is 115414-91-0.
What is the molecular formula of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate?
The molecular formula of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate is C16H16O4.
What is the molecular weight of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate?
The molecular weight of Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate is 272.10486 g/mol.
Where can I buy Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate?
You can request a quote for Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-{5-[(methoxycarbonyl)methyl]naphthyl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.