2,3,6-Trifluorophenol - ≥95%(GC) , CAS No.113798-74-6

CAS: 113798-74-6 Cat. No.: T162421 Summenformel: C6H3F3O Molekulargewicht: 148.08 EG-Nummer: 625-392-6 PubChem CID: 517988
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GRADE & PURITY ≥95%(GC)
Synonyms
T3129 | W16624 | A803096 | SCHEMBL78147 | 2,3,6-trifluoro phenol | DTXSID00333764 | J-003025 | AMY14256 | PS-10214 | BP-10565 | Phenol, 2,3,6-trifluoro- | AKOS006222973 | 2,3,6-Trifluorophenol, 98% | 2,3,6-Trifluorophenol | MFCD00061214 | FT-0609486
Storage
Room temperature
Shipped In
Normal
Size
Deutschland (EU)
USA*
Price
Qty
1g
T162421-1g
2 Auf Lager

27,68€

41,56€
Speichern 13,88 € (33.40%)
5g
T162421-5g
Auf Bestellung · 8–12 Wochen

29,42€

44,17€
Speichern 14,75 € (33.40%)
10g
T162421-10g
Auf Bestellung · 8–12 Wochen

42,43€

64,13€
Speichern 21,69 € (33.83%)
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Why this grade

≥95%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

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

Synonyme
T3129 | W16624 | A803096 | SCHEMBL78147 | 2,3,6-trifluoro phenol | DTXSID00333764 | J-003025 | AMY14256 | PS-10214 | BP-10565 | Phenol, 2,3,6-trifluoro- | AKOS006222973 | 2,3,6-Trifluorophenol, 98% | 2,3,6-Trifluorophenol | MFCD00061214 | FT-0609486
Spezifikationen & Reinheit
≥95%(GC)
Storage
Room temperature
Verschickt in
Normal
Reinheit
≥95%(GC)
Namen und Kennungen
Pubchem Sid508807624
Kanonisches LächelnC1=CC(=C(C(=C1F)O)F)F
IUPAC Name2,3,6-trifluorophenol
InChIKeyQSFGUSFDWCVXNR-UHFFFAOYSA-N
INCHI1S/C6H3F3O/c7-3-1-2-4(8)6(10)5(3)9/h1-2,10H
Isomere SMILES C1=CC(=C(C(=C1F)O)F)F
WGK Deutschland 3
PubChem CID 517988
Molekulargewicht 148.08
Reaxy-Rn 4976927

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

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
KlassePhenols
SubclassHalophenols
Intermediate Tree Nodes Fluorophenols
Direct ParentO-fluorophenols
Alternative Parents M-fluorophenols  Fluorobenzenes  1-hydroxy-4-unsubstituted benzenoids  Aryl fluorides  Organooxygen compounds  Organofluorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 2-fluorophenol - 3-fluorophenol - 1-hydroxy-4-unsubstituted benzenoid - Halobenzene - Fluorobenzene - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as o-fluorophenols. These are fluorophenols carrying a iodine at the C2 position of the benzene ring.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

2 results found

Lot NumberCertificate TypeDatumArtikel
L2410188Certificate of AnalysisDec 21, 2024 T162421
D2024087Certificate of AnalysisFeb 26, 2024 T162421
Chemische und physikalische Eigenschaften
LöslichkeitSoluble in water (47.267 mg/L est.)
EmpfindlichkeitMoisture sensitive.
Flammpunkt (°F)147.2 °F
Flammpunkt (°C)64 °C
Schmelzpunkt (°C)31-36°C
Molekulargewicht148.080 g/mol
XLogP31.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass148.014 Da
Monoisotopic Mass148.014 Da
Topological Polar Surface Area20.200 Ų
Heavy Atom Count10
Formal Charge0
Complexity120.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Lösungsrechner
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