2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone
TL;DR: 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone (CAS 163882-72-2) is a chemical compound with molecular formula C9H11F3O and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trifluoro-1-(2-methylcyclohexen-1-yl)ethanone
Also Known As: 2,2,2-trifluoro-1-(2-methylcyclohexen-1-yl)ethanone, 2,2,2-trifluoro-1-(2-methyl-1-cyclohexenyl)ethanone, Ethanone, 2,2,2-trifluoro-1-(2-methyl-1-cyclohexen-1-yl)- (9CI), 2,2,2-TRIFLUORO-1-(2-METHYL-1-CYCLOHEXEN-1-YL)-ETHANONE, 2,2,2-Trifluoro-1-(2-methylcyclohex-1-en-1-yl)ethan-1-one
| Molecular Formula | C9H11F3O |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 3.0083 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 192.0762 |
| Heavy Atoms | 13 |
| Complexity | 250.07565 |
Chemical Identifiers
| CAS Number | 163882-72-2 |
|---|---|
| SMILES | CC1=C(CCCC1)C(=O)C(F)(F)F |
Product Overview
2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone (CAS 163882-72-2), with molecular formula C9H11F3O and molecular weight 192.08 g/mol. IUPAC: 2,2,2-trifluoro-1-(2-methylcyclohexen-1-yl)ethanone.
Chemical Property Profile of 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone
Property Insights of 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone
The XLogP value of 3.0083 indicates that 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone 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 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone?
The CAS number of 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone is 163882-72-2.
What is the molecular formula of 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone?
The molecular formula of 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone is C9H11F3O.
What is the molecular weight of 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone?
The molecular weight of 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone is 192.08 g/mol.
Where can I buy 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone?
You can request a quote for 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-Trifluoro-1-(2-methylcyclohexen-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.