![2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile structure](/static/products/445/445002-67-5.png)
2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile
TL;DR: 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile (CAS 445002-67-5) is a chemical compound with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile
Also Known As: {4-[(hydroxyimino)methyl]-2-methoxyphenoxy}acetonitrile, 2-[4-(hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile, {4-[(E)-(hydroxyimino)methyl]-2-methoxyphenoxy}acetonitrile
| Molecular Formula | C10H10N2O3 |
|---|---|
| Molecular Weight | 206.07 g/mol |
| LogP | 1.40568 |
| Topological Polar Surface Area | 74.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.06914 |
| Heavy Atoms | 15 |
| Complexity | 396.14423 |
Chemical Identifiers
| CAS Number | 445002-67-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=NO)OCC#N |
Product Overview
2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile (CAS 445002-67-5), with molecular formula C10H10N2O3 and molecular weight 206.07 g/mol. IUPAC: 2-[4-(hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile.
Chemical Property Profile of 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile
Property Insights of 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile
The XLogP value of 1.40568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile. The TPSA of 74.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile. Following Lipinski's Rule of Five, 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile has 1 hydrogen bond donor(s) and 5 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-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile?
The CAS number of 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile is 445002-67-5.
What is the molecular formula of 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile?
The molecular formula of 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile is C10H10N2O3.
What is the molecular weight of 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile?
The molecular weight of 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile is 206.07 g/mol.
Where can I buy 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile?
You can request a quote for 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]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-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(Hydroxyiminomethyl)-2-methoxyphenoxy]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.