2-Naphthalenethanoic acid, 3-methoxy-
TL;DR: 2-Naphthalenethanoic acid, 3-methoxy- (CAS 150714-54-8) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methoxynaphthalen-2-yl)acetic acid
Also Known As: 3-Methoxynaphthalene-2-acetic acid, (3-Methoxy-2-naphthyl)acetic acid, (3-Methoxy-2-naphthyl)acetic acid #, 2-Naphthalenethanoic acid, 3-methoxy-, 2-(3-methoxynaphthalen-2-yl)acetic acid
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 150714-54-8 |
|---|---|
| SMILES | COC1=CC2=CC=CC=C2C=C1CC(=O)O |
| InChIKey | ZHPPOHBPOUWWRB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Naphthalenethanoic acid, 3-methoxy- (CAS 150714-54-8), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: 2-(3-methoxynaphthalen-2-yl)acetic acid.
Chemical Property Profile of 2-Naphthalenethanoic acid, 3-methoxy-
Property Insights of 2-Naphthalenethanoic acid, 3-methoxy-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Naphthalenethanoic acid, 3-methoxy-. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Naphthalenethanoic acid, 3-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthalenethanoic acid, 3-methoxy- 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 2-Naphthalenethanoic acid, 3-methoxy-?
The CAS number of 2-Naphthalenethanoic acid, 3-methoxy- is 150714-54-8.
What is the molecular formula of 2-Naphthalenethanoic acid, 3-methoxy-?
The molecular formula of 2-Naphthalenethanoic acid, 3-methoxy- is C13H12O3.
What is the molecular weight of 2-Naphthalenethanoic acid, 3-methoxy-?
The molecular weight of 2-Naphthalenethanoic acid, 3-methoxy- is 216.08 g/mol.
Where can I buy 2-Naphthalenethanoic acid, 3-methoxy-?
You can request a quote for 2-Naphthalenethanoic acid, 3-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthalenethanoic acid, 3-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthalenethanoic acid, 3-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.