Cyclobutyl phenyl ketone
TL;DR: Cyclobutyl phenyl ketone (CAS 5407-98-7) is a chemical compound with molecular formula C11H12O and molecular weight 160.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclobutyl(phenyl)methanone
Also Known As: Cyclobutyl phenyl ketone, Cyclobutyl(phenyl)methanone, Benzoylcyclobutane, Methanone, cyclobutylphenyl-, Cyclobutylphenylketon
| Molecular Formula | C11H12O |
|---|---|
| Molecular Weight | 160.09 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.08882 |
| Heavy Atoms | 12 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 5407-98-7 |
|---|---|
| SMILES | C1CC(C1)C(=O)C2=CC=CC=C2 |
| InChIKey | MVEBDOSCXOQNAR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclobutyl phenyl ketone (CAS 5407-98-7), with molecular formula C11H12O and molecular weight 160.09 g/mol. IUPAC: cyclobutyl(phenyl)methanone.
Chemical Property Profile of Cyclobutyl phenyl ketone
Property Insights of Cyclobutyl phenyl ketone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclobutyl phenyl ketone. With a topological polar surface area (TPSA) of 17.1 Ų, Cyclobutyl phenyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclobutyl phenyl 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 Cyclobutyl phenyl ketone?
The CAS number of Cyclobutyl phenyl ketone is 5407-98-7.
What is the molecular formula of Cyclobutyl phenyl ketone?
The molecular formula of Cyclobutyl phenyl ketone is C11H12O.
What is the molecular weight of Cyclobutyl phenyl ketone?
The molecular weight of Cyclobutyl phenyl ketone is 160.09 g/mol.
Where can I buy Cyclobutyl phenyl ketone?
You can request a quote for Cyclobutyl phenyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclobutyl phenyl ketone?
Yes, KEHONG BIO provides custom synthesis services for Cyclobutyl phenyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.