2-Decanone, 1,1,1-trifluoro-
TL;DR: 2-Decanone, 1,1,1-trifluoro- (CAS 26902-68-1) is a chemical compound with molecular formula C10H17F3O and molecular weight 210.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1-trifluorodecan-2-one
Also Known As: 2-Decanone, 1,1,1-trifluoro-, 1,1,1-trifluorodecan-2-one, Trifluoromethyloctyl ketone, 1,1,1-Trifluoro-2-decanone, 1,1,1-Trifluorodecane-2-one
| Molecular Formula | C10H17F3O |
|---|---|
| Molecular Weight | 210.12 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 210.12315 |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 26902-68-1 |
|---|---|
| SMILES | CCCCCCCCC(=O)C(F)(F)F |
| InChIKey | OQHGRUHRHLFMBX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Decanone, 1,1,1-trifluoro- (CAS 26902-68-1), with molecular formula C10H17F3O and molecular weight 210.12 g/mol. IUPAC: 1,1,1-trifluorodecan-2-one.
Chemical Property Profile of 2-Decanone, 1,1,1-trifluoro-
Property Insights of 2-Decanone, 1,1,1-trifluoro-
The XLogP value of 4.8 indicates that 2-Decanone, 1,1,1-trifluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Decanone, 1,1,1-trifluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Decanone, 1,1,1-trifluoro- has 0 hydrogen bond donor(s) and 4 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-Decanone, 1,1,1-trifluoro-?
The CAS number of 2-Decanone, 1,1,1-trifluoro- is 26902-68-1.
What is the molecular formula of 2-Decanone, 1,1,1-trifluoro-?
The molecular formula of 2-Decanone, 1,1,1-trifluoro- is C10H17F3O.
What is the molecular weight of 2-Decanone, 1,1,1-trifluoro-?
The molecular weight of 2-Decanone, 1,1,1-trifluoro- is 210.12 g/mol.
Where can I buy 2-Decanone, 1,1,1-trifluoro-?
You can request a quote for 2-Decanone, 1,1,1-trifluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Decanone, 1,1,1-trifluoro-?
Yes, KEHONG BIO provides custom synthesis services for 2-Decanone, 1,1,1-trifluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.