Determine the necessary mass, volume, or concentration for preparing a solution.
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≥90% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Application
Alternative to gaseous unstable trifluoroacetaldehyde: used to prepare α-trifluoromethylated alcohols for antifungals, antitumor, and chemotherapeutic agents.
| Canonical Smiles | CCOC(C(F)(F)F)O |
|---|---|
| IUPAC Name | 1-ethoxy-2,2,2-trifluoroethanol |
| InChIKey | KLXJPQNHFFMLIG-UHFFFAOYSA-N |
| INCHI | 1S/C4H7F3O2/c1-2-9-3(8)4(5,6)7/h3,8H,2H2,1H3 |
| Isomeric SMILES | CCOC(C(F)(F)F)O |
| PubChem CID | 9897 |
| Molecular Weight | 144.09 |
| Reaxy-Rn | 906797 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organohalogen compounds |
| Class | Halohydrins |
| Subclass | Fluorohydrins |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Fluorohydrins |
| Alternative Parents | Hemiacetals Organofluorides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Hemiacetal - Fluorohydrin - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as fluorohydrins. These are alcohols substituted by a fluorine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl groups. |
| External Descriptors | Not available |
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| Refractive Index | 1.34 |
|---|---|
| Flash Point(°F) | 102.2℉ |
| Flash Point(°C) | 39°C(lit.) |
| Boil Point(°C) | 104-105 °C/745 mmHg |
| Molecular Weight | 144.090 g/mol |
| XLogP3 | 1.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 144.04 Da |
| Monoisotopic Mass | 144.04 Da |
| Topological Polar Surface Area | 29.500 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 80.400 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |