2-(6-methoxy-1H-indol-3-yl)acetonitrile
TL;DR: 2-(6-methoxy-1H-indol-3-yl)acetonitrile (CAS 23084-35-7) is a chemical compound with molecular formula C11H10N2O and molecular weight 186.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-methoxy-1H-indol-3-yl)acetonitrile
Also Known As: 2-(6-methoxy-1H-indol-3-yl)acetonitrile, 6-Methoxyindole-3-acetonitrile, 1H-Indole-3-acetonitrile, 6-methoxy-, 3-Cyanomethyl-6-methoxy-1H-indole, 1H-Indole-3-acetonitrile,6-methoxy-
| Molecular Formula | C11H10N2O |
|---|---|
| Molecular Weight | 186.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 48.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.07932 |
| Heavy Atoms | 14 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 23084-35-7 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=CN2)CC#N |
| InChIKey | TXDMKKKJRXIVNO-UHFFFAOYSA-N |
Product Overview
2-(6-methoxy-1H-indol-3-yl)acetonitrile (CAS 23084-35-7), with molecular formula C11H10N2O and molecular weight 186.08 g/mol. IUPAC: 2-(6-methoxy-1H-indol-3-yl)acetonitrile.
Chemical Property Profile of 2-(6-methoxy-1H-indol-3-yl)acetonitrile
Property Insights of 2-(6-methoxy-1H-indol-3-yl)acetonitrile
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6-methoxy-1H-indol-3-yl)acetonitrile. With a topological polar surface area (TPSA) of 48.8 Ų, 2-(6-methoxy-1H-indol-3-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(6-methoxy-1H-indol-3-yl)acetonitrile 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
Frequently Asked Questions
What is the CAS number of 2-(6-methoxy-1H-indol-3-yl)acetonitrile?
The CAS number of 2-(6-methoxy-1H-indol-3-yl)acetonitrile is 23084-35-7.
What is the molecular formula of 2-(6-methoxy-1H-indol-3-yl)acetonitrile?
The molecular formula of 2-(6-methoxy-1H-indol-3-yl)acetonitrile is C11H10N2O.
What is the molecular weight of 2-(6-methoxy-1H-indol-3-yl)acetonitrile?
The molecular weight of 2-(6-methoxy-1H-indol-3-yl)acetonitrile is 186.08 g/mol.
Where can I buy 2-(6-methoxy-1H-indol-3-yl)acetonitrile?
You can request a quote for 2-(6-methoxy-1H-indol-3-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-methoxy-1H-indol-3-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(6-methoxy-1H-indol-3-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.