![Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- structure](/static/products/6503/65031-14-3.webp)
Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-
TL;DR: Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- (CAS 65031-14-3) is a chemical compound with molecular formula C11H7NO3 and molecular weight 201.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxochromen-7-yl)oxyacetonitrile
Also Known As: 2-(2-oxochromen-7-yl)oxyacetonitrile, 2-((2-Oxo-2H-chromen-7-yl)oxy)acetonitrile, 2-[(2-oxo-2H-chromen-7-yl)oxy]acetonitrile, Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-, [(2-Oxo-2H-1-benzopyran-7-yl)oxy]acetonitrile
| Molecular Formula | C11H7NO3 |
|---|---|
| Molecular Weight | 201.04 g/mol |
| LogP | 1.69538 |
| Topological Polar Surface Area | 63.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.04259 |
| Heavy Atoms | 15 |
| Complexity | 580.1381 |
Chemical Identifiers
| CAS Number | 65031-14-3 |
|---|---|
| SMILES | C1=CC(=CC2=C1C=CC(=O)O2)OCC#N |
Product Overview
Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- (CAS 65031-14-3), with molecular formula C11H7NO3 and molecular weight 201.04 g/mol. IUPAC: 2-(2-oxochromen-7-yl)oxyacetonitrile.
Chemical Property Profile of Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-
Property Insights of Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-
The XLogP value of 1.69538 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-. The TPSA of 63.23 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-. Following Lipinski's Rule of Five, Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- 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 Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-?
The CAS number of Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- is 65031-14-3.
What is the molecular formula of Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-?
The molecular formula of Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- is C11H7NO3.
What is the molecular weight of Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-?
The molecular weight of Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- is 201.04 g/mol.
Where can I buy Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-?
You can request a quote for Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]-?
Yes, KEHONG BIO provides custom synthesis services for Acetonitrile, [(2-oxo-2H-1-benzopyran-7-yl)oxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.