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· · COA & SDS available for every product · Same-day shipping on in-stock items 1,1,1-Trifluoro-2-(trifluoromethyl)-4-penten-2-ol - ≥98%(GC) , CAS No.646-97-9
Synonyms
J-503694 | 1,1,1-Trifluoro-2-(trifluoromethyl)-4-penten-2-ol # | 1,1,1-trifluoro-2-(trifluoromethyl)pent-4-en-2-ol | 4-Penten-2-ol,1,1-trifluoro-2-(trifluoromethyl)- | AMY6825 | BTHB | MFCD03092986 | FT-0610995 | 1,1,1-trifluoro-2-trifluoromethyl-pent-4-e
Storage
Store at 2-8°C,Argon charged
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Why this grade ≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
J-503694 | 1, 1, 1-Trifluoro-2-(trifluoromethyl)-4-penten-2-ol # | 1, 1, 1-trifluoro-2-(trifluoromethyl)pent-4-en-2-ol | 4-Penten-2-ol, 1, 1-trifluoro-2-(trifluoromethyl)- | AMY6825 | BTHB | MFCD03092986 | FT-0610995 | 1, 1, 1-trifluoro-2-trifluoromethyl-pent-4-e
Specifications & Purity
≥98%(GC)
Storage
Store at 2-8°C, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles C=CCC(C(F)(F)F)(C(F)(F)F)O IUPAC Name 1,1,1-trifluoro-2-(trifluoromethyl)pent-4-en-2-ol InChIKey VHSCQANAKTXZTG-UHFFFAOYSA-N INCHI 1S/C6H6F6O/c1-2-3-4(13,5(7,8)9)6(10,11)12/h2,13H,1,3H2 Isomeric SMILES C=CCC(C(F)(F)F)(C(F)(F)F)O UN Number 1993 Packing Group II Molecular Weight 208.10 Reaxy-Rn 1841600
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organic oxygen compounds Class Organooxygen compounds Subclass Alcohols and polyols Intermediate Tree Nodes Not available Direct Parent Tertiary alcohols Alternative Parents Fluorohydrins Organofluorides Hydrocarbon derivatives Alkyl fluorides Molecular Framework Aliphatic acyclic compounds Substituents Tertiary alcohol - Halohydrin - Fluorohydrin - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound Description This compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Air Sensitive Refractive Index 1.33 Flash Point(°C) 26 °C Boil Point(°C) 100°C(lit.) Molecular Weight 208.100 g/mol XLogP3 2.800 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 7 Rotatable Bond Count 2 Exact Mass 208.032 Da Monoisotopic Mass 208.032 Da Topological Polar Surface Area 20.200 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 176.000 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
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