![2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile structure](/static/products/869/869079-65-2.png)
2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile
TL;DR: 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile (CAS 869079-65-2) is a chemical compound with molecular formula C18H13NO3 and molecular weight 291.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2-oxo-3-phenylchromen-7-yl)oxyacetonitrile
Also Known As: 2-(4-methyl-2-oxo-3-phenylchromen-7-yl)oxyacetonitrile, 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile, 2-((4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy)acetonitrile, F1862-0133, 2-(4-methyl-2-oxo-3-phenylchromen-7-yloxy)ethanenitrile
| Molecular Formula | C18H13NO3 |
|---|---|
| Molecular Weight | 291.09 g/mol |
| LogP | 3.6708 |
| Topological Polar Surface Area | 63.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.08954 |
| Heavy Atoms | 22 |
| Complexity | 920.7005 |
Chemical Identifiers
| CAS Number | 869079-65-2 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)OCC#N)C3=CC=CC=C3 |
Product Overview
2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile (CAS 869079-65-2), with molecular formula C18H13NO3 and molecular weight 291.09 g/mol. IUPAC: 2-(4-methyl-2-oxo-3-phenylchromen-7-yl)oxyacetonitrile.
Chemical Property Profile of 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile
Property Insights of 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile
The XLogP value of 3.6708 indicates that 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile. Following Lipinski's Rule of Five, 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile has 0 hydrogen bond donor(s) and 4 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-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile?
The CAS number of 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile is 869079-65-2.
What is the molecular formula of 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile?
The molecular formula of 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile is C18H13NO3.
What is the molecular weight of 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile?
The molecular weight of 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile is 291.09 g/mol.
Where can I buy 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile?
You can request a quote for 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-methyl-2-oxo-3-phenyl-2H-chromen-7-yl)oxy]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.