Cyclopentyl methyl ketone
TL;DR: Cyclopentyl methyl ketone (CAS 6004-60-0) is a chemical compound with molecular formula C7H12O and molecular weight 112.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclopentylethanone
Also Known As: 1-CYCLOPENTYLETHANONE, 1-Cyclopentyl-ethanone, Cyclopentyl methyl ketone, Ethanone, 1-cyclopentyl-, Cyclopentylethanone
| Molecular Formula | C7H12O |
|---|---|
| Molecular Weight | 112.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.08881 |
| Heavy Atoms | 8 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 6004-60-0 |
|---|---|
| SMILES | CC(=O)C1CCCC1 |
| InChIKey | LKENTYLPIUIMFG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopentyl methyl ketone (CAS 6004-60-0), with molecular formula C7H12O and molecular weight 112.09 g/mol. IUPAC: 1-cyclopentylethanone.
Chemical Property Profile of Cyclopentyl methyl ketone
Property Insights of Cyclopentyl methyl ketone
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentyl methyl ketone. With a topological polar surface area (TPSA) of 17.1 Ų, Cyclopentyl methyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentyl methyl ketone 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 Cyclopentyl methyl ketone?
The CAS number of Cyclopentyl methyl ketone is 6004-60-0.
What is the molecular formula of Cyclopentyl methyl ketone?
The molecular formula of Cyclopentyl methyl ketone is C7H12O.
What is the molecular weight of Cyclopentyl methyl ketone?
The molecular weight of Cyclopentyl methyl ketone is 112.09 g/mol.
Where can I buy Cyclopentyl methyl ketone?
You can request a quote for Cyclopentyl methyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentyl methyl ketone?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentyl methyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.