Cyclohexenone oxime
TL;DR: Cyclohexenone oxime (CAS 2228-75-3) is a chemical compound with molecular formula C6H9NO and molecular weight 111.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohex-2-en-1-ylidenehydroxylamine
Also Known As: cyclohexenone oxime, Cyclohexenone, oxime, 2-Cyclohexen-1-one oxime, 2-Cyclohexen-1-one, oxime, (Z)-, Na(Cyclohexa2aena1aylidene)hydroxylamine
| Molecular Formula | C6H9NO |
|---|---|
| Molecular Weight | 111.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 111.06841 |
| Heavy Atoms | 8 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 2228-75-3 |
|---|---|
| SMILES | C1CC=CC(=NO)C1 |
| InChIKey | WNPVAXLJVUXYFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexenone oxime (CAS 2228-75-3), with molecular formula C6H9NO and molecular weight 111.07 g/mol. IUPAC: N-cyclohex-2-en-1-ylidenehydroxylamine.
Chemical Property Profile of Cyclohexenone oxime
Property Insights of Cyclohexenone oxime
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexenone oxime. With a topological polar surface area (TPSA) of 32.6 Ų, Cyclohexenone oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexenone oxime 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 Cyclohexenone oxime?
The CAS number of Cyclohexenone oxime is 2228-75-3.
What is the molecular formula of Cyclohexenone oxime?
The molecular formula of Cyclohexenone oxime is C6H9NO.
What is the molecular weight of Cyclohexenone oxime?
The molecular weight of Cyclohexenone oxime is 111.07 g/mol.
Where can I buy Cyclohexenone oxime?
You can request a quote for Cyclohexenone oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexenone oxime?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexenone oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.