Methacrylaldoxime
TL;DR: Methacrylaldoxime (CAS 72589-84-5) is a chemical compound with molecular formula C4H7NO and molecular weight 85.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylprop-2-enylidene)hydroxylamine
Also Known As: methacrylaldoxime, N-(2-methylprop-2-enylidene)hydroxylamine, (NE)-N-(2-methylprop-2-enylidene)hydroxylamine
| Molecular Formula | C4H7NO |
|---|---|
| Molecular Weight | 85.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 85.052765 |
| Heavy Atoms | 6 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 72589-84-5 |
|---|---|
| SMILES | CC(=C)C=NO |
| InChIKey | RNQUXGAIVHPEHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methacrylaldoxime (CAS 72589-84-5), with molecular formula C4H7NO and molecular weight 85.05 g/mol. IUPAC: N-(2-methylprop-2-enylidene)hydroxylamine.
Chemical Property Profile of Methacrylaldoxime
Property Insights of Methacrylaldoxime
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methacrylaldoxime. With a topological polar surface area (TPSA) of 32.6 Ų, Methacrylaldoxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methacrylaldoxime 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 Methacrylaldoxime?
The CAS number of Methacrylaldoxime is 72589-84-5.
What is the molecular formula of Methacrylaldoxime?
The molecular formula of Methacrylaldoxime is C4H7NO.
What is the molecular weight of Methacrylaldoxime?
The molecular weight of Methacrylaldoxime is 85.05 g/mol.
Where can I buy Methacrylaldoxime?
You can request a quote for Methacrylaldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methacrylaldoxime?
Yes, KEHONG BIO provides custom synthesis services for Methacrylaldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.