1-Acetylcyclohexene
TL;DR: 1-Acetylcyclohexene (CAS 932-66-1) is a chemical compound with molecular formula C8H12O and molecular weight 124.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(cyclohexen-1-yl)ethanone
Also Known As: 1-Acetyl-1-cyclohexene, 1-Acetylcyclohexene, 1-(cyclohex-1-en-1-yl)ethanone, 1-(cyclohexen-1-yl)ethanone, Methyl 1-cyclohexenyl ketone
| Molecular Formula | C8H12O |
|---|---|
| Molecular Weight | 124.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 124.08881 |
| Heavy Atoms | 9 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 932-66-1 |
|---|---|
| SMILES | CC(=O)C1=CCCCC1 |
| InChIKey | LTYLUDGDHUEBGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Acetylcyclohexene (CAS 932-66-1), with molecular formula C8H12O and molecular weight 124.09 g/mol. IUPAC: 1-(cyclohexen-1-yl)ethanone.
Chemical Property Profile of 1-Acetylcyclohexene
Property Insights of 1-Acetylcyclohexene
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Acetylcyclohexene. With a topological polar surface area (TPSA) of 17.1 Ų, 1-Acetylcyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Acetylcyclohexene has 0 hydrogen bond donor(s) and 1 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 1-Acetylcyclohexene?
The CAS number of 1-Acetylcyclohexene is 932-66-1.
What is the molecular formula of 1-Acetylcyclohexene?
The molecular formula of 1-Acetylcyclohexene is C8H12O.
What is the molecular weight of 1-Acetylcyclohexene?
The molecular weight of 1-Acetylcyclohexene is 124.09 g/mol.
Where can I buy 1-Acetylcyclohexene?
You can request a quote for 1-Acetylcyclohexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Acetylcyclohexene?
Yes, KEHONG BIO provides custom synthesis services for 1-Acetylcyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.