1-Methylnaphthalene-5-acetic acid
TL;DR: 1-Methylnaphthalene-5-acetic acid (CAS 143226-03-3) is a chemical compound with molecular formula C13H12O2 and molecular weight 200.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(5-methylnaphthalen-1-yl)acetic acid
Also Known As: 1-Methylnaphthalene-5-acetic acid, 2-(5-methylnaphthalen-1-yl)acetic acid, (5-methylnaphthalen-1-yl)acetic acid
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H12O2 |
| Molecular Weight | 200.08372 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.08372 Da |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
| SMILES | CC1=C2C=CC=C(C2=CC=C1)CC(=O)O |
| InChIKey | KNOFPQKQSVAMJB-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methylnaphthalene-5-acetic acid
Property Insights of 1-Methylnaphthalene-5-acetic acid
The XLogP value of 3.5 indicates that 1-Methylnaphthalene-5-acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1-Methylnaphthalene-5-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylnaphthalene-5-acetic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methylnaphthalene-5-acetic acid?
The CAS number of 1-Methylnaphthalene-5-acetic acid is 143226-03-3.
What is the molecular formula of 1-Methylnaphthalene-5-acetic acid?
The molecular formula of 1-Methylnaphthalene-5-acetic acid is C13H12O2.
What is the molecular weight of 1-Methylnaphthalene-5-acetic acid?
The molecular weight of 1-Methylnaphthalene-5-acetic acid is 200.08372 g/mol.
Where can I buy 1-Methylnaphthalene-5-acetic acid?
You can request a quote for 1-Methylnaphthalene-5-acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methylnaphthalene-5-acetic acid?
Yes, CoreyChem provides custom synthesis services for 1-Methylnaphthalene-5-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.