2-(6-Methoxynaphthalen-2-yl)acetonitrile
TL;DR: 2-(6-Methoxynaphthalen-2-yl)acetonitrile (CAS 71056-96-7) is a chemical compound with molecular formula C13H11NO and molecular weight 197.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-methoxynaphthalen-2-yl)acetonitrile
Also Known As: 2-(6-methoxynaphthalen-2-yl)acetonitrile, 2- ACETONITRILE, 2-(6-METHOXY-2-NAPHTHYL)ACETONITRILE, 2-Cyanomethyl-6-methoxynaphthalene, (6-Methoxy-2-naphthyl)acetonitrile
| Molecular Formula | C13H11NO |
|---|---|
| Molecular Weight | 197.08 g/mol |
| LogP | 2.91448 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.08406 |
| Heavy Atoms | 15 |
| Complexity | 525.53723 |
Chemical Identifiers
| CAS Number | 71056-96-7 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C=C(C=C2)CC#N |
Product Overview
2-(6-Methoxynaphthalen-2-yl)acetonitrile (CAS 71056-96-7), with molecular formula C13H11NO and molecular weight 197.08 g/mol. IUPAC: 2-(6-methoxynaphthalen-2-yl)acetonitrile.
Chemical Property Profile of 2-(6-Methoxynaphthalen-2-yl)acetonitrile
Property Insights of 2-(6-Methoxynaphthalen-2-yl)acetonitrile
The XLogP value of 2.91448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6-Methoxynaphthalen-2-yl)acetonitrile. With a topological polar surface area (TPSA) of 33.02 Ų, 2-(6-Methoxynaphthalen-2-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(6-Methoxynaphthalen-2-yl)acetonitrile 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 2-(6-Methoxynaphthalen-2-yl)acetonitrile?
The CAS number of 2-(6-Methoxynaphthalen-2-yl)acetonitrile is 71056-96-7.
What is the molecular formula of 2-(6-Methoxynaphthalen-2-yl)acetonitrile?
The molecular formula of 2-(6-Methoxynaphthalen-2-yl)acetonitrile is C13H11NO.
What is the molecular weight of 2-(6-Methoxynaphthalen-2-yl)acetonitrile?
The molecular weight of 2-(6-Methoxynaphthalen-2-yl)acetonitrile is 197.08 g/mol.
Where can I buy 2-(6-Methoxynaphthalen-2-yl)acetonitrile?
You can request a quote for 2-(6-Methoxynaphthalen-2-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(6-Methoxynaphthalen-2-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(6-Methoxynaphthalen-2-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.