2-(2,2,2-Trifluoroacetyl)cyclohexanone - ≥95% , CAS No.387-89-3

CAS: 387-89-3 Cat. No.: T193139 Formule: C8H9F3O2 Poids moléculaire: 194.15 Numéro CE: 869-650-8 PubChem CID: 238413
DISPONIBLE À COMMANDE
GRADE & PURITY ≥95%
Synonyms
trifluoroacetylcyclohexanone | 2-(2,2,2-Trifluoroacetyl)cyclohexanone | MFCD07779548 | NSC42753 | NSC-42753 | AKOS000313456 | 2-(2,2,2-trifluoroacetyl)cyclohexan-1-one | DTXSID90285768 | 2-(trifluoroacetyl)cyclohexanone | Cyclohexanone, 2-(trifluoroacetyl
Storage
Room temperature
Shipped In
Normal
★
Size
USA
Allemagne (EU)*
Price
Qty
50mg
T193139-50mg
Sur commande · 8–12 semaines
110,90$US
250mg
T193139-250mg
Sur commande · 8–12 semaines
120,90$US
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

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.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonymes
trifluoroacetylcyclohexanone | 2-(2,2,2-Trifluoroacetyl)cyclohexanone | MFCD07779548 | NSC42753 | NSC-42753 | AKOS000313456 | 2-(2,2,2-trifluoroacetyl)cyclohexan-1-one | DTXSID90285768 | 2-(trifluoroacetyl)cyclohexanone | Cyclohexanone, 2-(trifluoroacetyl
Spécifications et pureté
≥95%
Conditions de stockage de stockage
Room temperature
Expédié en
Normal
Pureté
≥95%
Noms et identifiants
Sourires canoniquesC1CCC(=O)C(C1)C(=O)C(F)(F)F
IUPAC Name2-(2,2,2-trifluoroacetyl)cyclohexan-1-one
InChIKeyYDFLGIXUFCIELL-UHFFFAOYSA-N
INCHI1S/C8H9F3O2/c9-8(10,11)7(13)5-3-1-2-4-6(5)12/h5H,1-4H2
Isomères SMILES C1CCC(=O)C(C1)C(=O)C(F)(F)F
PubChem CID 238413
Poids moléculaire 194.15

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
SuperclassOrganic oxygen compounds
ClasseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes 1,3-dicarbonyl compounds
Direct ParentBeta-diketones
Alternative Parents Alpha-haloketones  Cyclic ketones  Organofluorides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents 1,3-diketone - Alpha-haloketone - Cyclic ketone - Ketone - Organic oxide - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as beta-diketones. These are organic compounds containing two keto groups separated by a single carbon atom.
External Descriptors Not available
Structure 3D
Modèle de structure chimique interactif





Mécanismes d'action
Certificats (CoA, COO, BSE/TSE et tableau d'analyse)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriétés chimiques et physiques
Poids moléculaire194.150 g/mol
XLogP32.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass194.055 Da
Monoisotopic Mass194.055 Da
Topological Polar Surface Area34.100 Ų
Heavy Atom Count13
Formal Charge0
Complexity232.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculateurs de solution
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