TL;DR: 1-Naphthaleneacetic acid, 2-methoxy- (CAS 10441-48-2) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methoxynaphthalen-1-yl)acetic acid
Also Known As: 2-(2-methoxynaphthalen-1-yl)acetic Acid, (2-methoxy-1-naphthyl)acetic acid, 1-Naphthaleneacetic acid, 2-methoxy-, 2-(2-methoxy-1-naphthyl)acetic acid, methoxy-(2-naphtyl) acetic acid
| Molecular Formula | C13H12O3 |
| Molecular Weight | 216.07864 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.07864 Da |
| Heavy Atoms | 16 |
| Complexity | 252.0 |
| SMILES | COC1=C(C2=CC=CC=C2C=C1)CC(=O)O |
| InChIKey | LENIVOVJFPDRLS-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Naphthaleneacetic acid, 2-methoxy-. With a topological polar surface area (TPSA) of 46.5 Ų, 1-Naphthaleneacetic acid, 2-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthaleneacetic acid, 2-methoxy- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Naphthaleneacetic acid, 2-methoxy- is 10441-48-2.
The molecular formula of 1-Naphthaleneacetic acid, 2-methoxy- is C13H12O3.
The molecular weight of 1-Naphthaleneacetic acid, 2-methoxy- is 216.07864 g/mol.
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