Cyclohexenylacetophenone
TL;DR: Cyclohexenylacetophenone (CAS 101831-38-3) is a chemical compound with molecular formula C14H16O and molecular weight 200.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(cyclohexen-1-yl)-1-phenylethanone
Also Known As: cyclohexenylacetophenone, 2-(cyclohex-1-en-1-yl)-1-phenylethanone, 2-(cyclohexen-1-yl)-1-phenylethanone, 2-(Cyclohex-1-en-1-yl)-1-phenylethan-1-one
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H16O |
| Molecular Weight | 200.12012 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.12012 Da |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
| SMILES | C1CCC(=CC1)CC(=O)C2=CC=CC=C2 |
| InChIKey | FSNQTROARHXTQN-UHFFFAOYSA-N |
Chemical Property Profile of Cyclohexenylacetophenone
Property Insights of Cyclohexenylacetophenone
The XLogP value of 3.3 indicates that Cyclohexenylacetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Cyclohexenylacetophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexenylacetophenone 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 Cyclohexenylacetophenone?
The CAS number of Cyclohexenylacetophenone is 101831-38-3.
What is the molecular formula of Cyclohexenylacetophenone?
The molecular formula of Cyclohexenylacetophenone is C14H16O.
What is the molecular weight of Cyclohexenylacetophenone?
The molecular weight of Cyclohexenylacetophenone is 200.12012 g/mol.
Where can I buy Cyclohexenylacetophenone?
You can request a quote for Cyclohexenylacetophenone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclohexenylacetophenone?
Yes, CoreyChem provides custom synthesis services for Cyclohexenylacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.