Cyclohexenylacetophenone
TL;DR: Cyclohexenylacetophenone (CAS 101831-38-3) is a chemical compound with molecular formula C14H16O and molecular weight 200.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C14H16O |
|---|---|
| Molecular Weight | 200.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.12012 |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 101831-38-3 |
|---|---|
| SMILES | C1CCC(=CC1)CC(=O)C2=CC=CC=C2 |
| InChIKey | FSNQTROARHXTQN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexenylacetophenone (CAS 101831-38-3), with molecular formula C14H16O and molecular weight 200.12 g/mol. IUPAC: 2-(cyclohexen-1-yl)-1-phenylethanone.
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
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 200.12 g/mol.
Where can I buy Cyclohexenylacetophenone?
You can request a quote for Cyclohexenylacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexenylacetophenone?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexenylacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.