2-(Trifluoromethyl)cyclohexanone , CAS No.56734-74-8

CAS: 56734-74-8 Cat. No.: T171022 Peso molecular: 166.14 Número EC: 692-593-3 PubChem CID: 2777488
Disponible para pedir
Synonyms
FT-0608969 | AS-61059 | EN300-84005 | DTXSID80380534 | 2-(Trifluoromethyl)cyclohexanone, AldrichCPR | 2-Trifluoromethylcyclohexanone | BBL101426 | STL555222 | AMY42362 | 2-(trifluoromethyl)cyclohexanone | SCHEMBL2105778 | 2-(trifluoromethyl)-cyclohexan-1-
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
T171022-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

117,90US$

138,90US$
Guardar 21,00 US$ (15.12%)
1g
T171022-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

294,90US$

344,90US$
Guardar 50,00 US$ (14.50%)
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Why this grade

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

Sinónimos
FT-0608969 | AS-61059 | EN300-84005 | DTXSID80380534 | 2-(Trifluoromethyl)cyclohexanone, AldrichCPR | 2-Trifluoromethylcyclohexanone | BBL101426 | STL555222 | AMY42362 | 2-(trifluoromethyl)cyclohexanone | SCHEMBL2105778 | 2-(trifluoromethyl)-cyclohexan-1-
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Nombres e identificadores
Sonrisas canónicasC1CCC(=O)C(C1)C(F)(F)F
IUPAC Name2-(trifluoromethyl)cyclohexan-1-one
InChIKeyRZSQHJQIBOWYSQ-UHFFFAOYSA-N
INCHI1S/C7H9F3O/c8-7(9,10)5-3-1-2-4-6(5)11/h5H,1-4H2
Isómeros SMILES C1CCC(=O)C(C1)C(F)(F)F
PubChem CID 2777488
Peso molecular 166.14

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
ClaseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones
Direct ParentCyclic ketones
Alternative Parents Organofluorides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents Cyclic ketone - Organic oxide - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular166.140 g/mol
XLogP32.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass166.061 Da
Monoisotopic Mass166.061 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count11
Formal Charge0
Complexity162.000
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
Calculadoras de soluciones
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