2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile
TL;DR: 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile (CAS 76104-14-8) is a chemical compound with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyimino-2-(4-methoxyphenyl)acetonitrile
Also Known As: 2-hydroxyimino-2-(4-methoxyphenyl)acetonitrile, alpha-hydroxyimino-4-methoxybenzylcyanide, alpha-hydroxyimino-4-methoxy-benzylcyanide, alpha-hydroxyimino-4-methoxybenzyl cyanide, (Hydroxyimino)(4-methoxyphenyl)acetonitrile
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 1.39708 |
| Topological Polar Surface Area | 65.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 348.87262 |
Chemical Identifiers
| CAS Number | 76104-14-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=NO)C#N |
Product Overview
2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile (CAS 76104-14-8), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 2-hydroxyimino-2-(4-methoxyphenyl)acetonitrile.
Chemical Property Profile of 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile
Property Insights of 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile
The XLogP value of 1.39708 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile. The TPSA of 65.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile. Following Lipinski's Rule of Five, 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile has 1 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-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile?
The CAS number of 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile is 76104-14-8.
What is the molecular formula of 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile?
The molecular formula of 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile is C9H8N2O2.
What is the molecular weight of 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile?
The molecular weight of 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile is 176.06 g/mol.
Where can I buy 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile?
You can request a quote for 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyimino-2-(4-methoxyphenyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.