Cyclopropyl 4-ethylphenyl ketone
TL;DR: Cyclopropyl 4-ethylphenyl ketone (CAS 50664-71-6) is a chemical compound with molecular formula C12H14O and molecular weight 174.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cyclopropyl-(4-ethylphenyl)methanone
Also Known As: Cyclopropyl 4-ethylphenyl ketone, cyclopropyl(4-ethylphenyl)methanone, cyclopropyl-(4-ethylphenyl)methanone, Cyclopropyl4-ethylphenylketone, Cyclopropyl-4-ethylphenylketon
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H14O |
| Molecular Weight | 174.10446 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.10446 Da |
| Heavy Atoms | 13 |
| Complexity | 185.0 |
| SMILES | CCC1=CC=C(C=C1)C(=O)C2CC2 |
| InChIKey | DNNQUDHIAKQKFH-UHFFFAOYSA-N |
Chemical Property Profile of Cyclopropyl 4-ethylphenyl ketone
Property Insights of Cyclopropyl 4-ethylphenyl ketone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopropyl 4-ethylphenyl ketone. With a topological polar surface area (TPSA) of 17.1 Ų, Cyclopropyl 4-ethylphenyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopropyl 4-ethylphenyl 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
What is the CAS number of Cyclopropyl 4-ethylphenyl ketone?
The CAS number of Cyclopropyl 4-ethylphenyl ketone is 50664-71-6.
What is the molecular formula of Cyclopropyl 4-ethylphenyl ketone?
The molecular formula of Cyclopropyl 4-ethylphenyl ketone is C12H14O.
What is the molecular weight of Cyclopropyl 4-ethylphenyl ketone?
The molecular weight of Cyclopropyl 4-ethylphenyl ketone is 174.10446 g/mol.
Where can I buy Cyclopropyl 4-ethylphenyl ketone?
You can request a quote for Cyclopropyl 4-ethylphenyl ketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclopropyl 4-ethylphenyl ketone?
Yes, CoreyChem provides custom synthesis services for Cyclopropyl 4-ethylphenyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.