≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal 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.
| Canonical Smiles | COC(=O)C(C(F)(F)F)(F)F |
|---|---|
| IUPAC Name | methyl 2,2,3,3,3-pentafluoropropanoate |
| InChIKey | JMKJCPUVEMZGEC-UHFFFAOYSA-N |
| INCHI | 1S/C4H3F5O2/c1-11-2(10)3(5,6)4(7,8)9/h1H3 |
| Isomeric SMILES | COC(=O)C(C(F)(F)F)(F)F |
| RTECS | UF6475500 |
| Molecular Weight | 178.06 |
| Beilstein | 1777501 |
| Reaxy-Rn | 1777501 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1777501&ln= |
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 | Alkyl halides |
| Subclass | Alkyl fluorides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Perfluoroalkyl carboxylic acid and derivatives |
| Alternative Parents | Methyl esters Alpha-halocarboxylic acid derivatives Monocarboxylic acids and derivatives Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Perfluoroalkyl carboxylic acid or derivatives - Methyl ester - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid derivative - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Carbonyl group - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as perfluoroalkyl carboxylic acid and derivatives. These are organic compounds containing an alkyl chain attached to the C-alpha of a carboxylic acid group (or a derivative thereof), where all hydrogens of the alkyl chain are replaced by fluorine atoms. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 E2628061 | Certificate of Analysis | Jun 09, 2026 | M121976 |
| H2209495 | Certificate of Analysis | May 20, 2026 | M121976 |
| H2209496 | Certificate of Analysis | May 20, 2026 | M121976 |
| G1421030 | Certificate of Analysis | Feb 05, 2026 | M121976 |
| K2120462 | Certificate of Analysis | Sep 04, 2025 | M121976 |
| J2528225 | Certificate of Analysis | Jun 29, 2022 | M121976 |
| Refractive Index | 1.288 |
|---|---|
| Flash Point(°F) | 6°C(Lit.) |
| Flash Point(°C) | 6°C(Lit.) |
| Boil Point(°C) | 60°C |
| Molecular Weight | 178.060 g/mol |
| XLogP3 | 1.800 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 178.005 Da |
| Monoisotopic Mass | 178.005 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 160.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
