6-Methoxynaphthalene-2-carbonitrile
TL;DR: 6-Methoxynaphthalene-2-carbonitrile (CAS 67886-70-8) is a chemical compound with molecular formula C12H9NO and molecular weight 183.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxynaphthalene-2-carbonitrile
Also Known As: 6-Methoxy-2-naphthonitrile, 2-Cyano-6-methoxynaphthalene, 6-methoxynaphthalene-2-carbonitrile, 6-Methoxy-2-cyanonaphthalene, Naproxen Nitrile Impurity
| Molecular Formula | C12H9NO |
|---|---|
| Molecular Weight | 183.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.06842 |
| Heavy Atoms | 14 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 67886-70-8 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C=C(C=C2)C#N |
| InChIKey | SWEFYGCKCMJSPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Methoxynaphthalene-2-carbonitrile (CAS 67886-70-8), with molecular formula C12H9NO and molecular weight 183.07 g/mol. IUPAC: 6-methoxynaphthalene-2-carbonitrile.
Chemical Property Profile of 6-Methoxynaphthalene-2-carbonitrile
Property Insights of 6-Methoxynaphthalene-2-carbonitrile
The XLogP value of 3.2 indicates that 6-Methoxynaphthalene-2-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.0 Ų, 6-Methoxynaphthalene-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxynaphthalene-2-carbonitrile has 0 hydrogen bond donor(s) and 2 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 6-Methoxynaphthalene-2-carbonitrile?
The CAS number of 6-Methoxynaphthalene-2-carbonitrile is 67886-70-8.
What is the molecular formula of 6-Methoxynaphthalene-2-carbonitrile?
The molecular formula of 6-Methoxynaphthalene-2-carbonitrile is C12H9NO.
What is the molecular weight of 6-Methoxynaphthalene-2-carbonitrile?
The molecular weight of 6-Methoxynaphthalene-2-carbonitrile is 183.07 g/mol.
Where can I buy 6-Methoxynaphthalene-2-carbonitrile?
You can request a quote for 6-Methoxynaphthalene-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxynaphthalene-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxynaphthalene-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.