4-hydroxy-4-(trifluoromethyl)cyclohexanone - ≥97% , CAS No.120929-90-0

CAS: 120929-90-0 Cat. No.: H627377 Fórmula: C7H9O2F3 Peso molecular: 182.14 Número CE: 866-144-9 PubChem CID: 20035142
Disponível para encomenda
GRADE & PURITY ≥97%
Synonyms
EN300-79129 | AKOS013584429 | PB39887 | SY186431 | SCHEMBL1372643 | Z1209979802 | 4-hydroxy-4-(trifluoromethyl)cyclohexanone | AS-78991 | 4-hydroxy-4-(trifluoromethyl)cyclohexan-1-one | 4-Hydroxy-4-trifluoromethylcyclohexanone | D79027 | MFCD18917407 | 4-
Storage
Room temperature
Shipped In
Normal
★
Size
USA
Alemanha (EU)*
Price
Qty
1g
H627377-1g
Sob encomenda · 8–12 semanas

646,90US$

970,90US$
Gravar 324,00 US$ (33.37%)
5g
H627377-5g
Sob encomenda · 8–12 semanas

2872,90US$

4309,90US$
Gravar 1 437,00 US$ (33.34%)
10g
H627377-10g
Sob encomenda · 8–12 semanas

3475,90US$

5213,90US$
Gravar 1 738,00 US$ (33.33%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% 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
EN300-79129 | AKOS013584429 | PB39887 | SY186431 | SCHEMBL1372643 | Z1209979802 | 4-hydroxy-4-(trifluoromethyl)cyclohexanone | AS-78991 | 4-hydroxy-4-(trifluoromethyl)cyclohexan-1-one | 4-Hydroxy-4-trifluoromethylcyclohexanone | D79027 | MFCD18917407 | 4-
Especificações e pureza
≥97%
Condições de armazenamento de armazenamento
Room temperature
Enviado em
Normal
Pureza
≥97%
Nomes e identificadores
Sorrisos canónicosC1CC(CCC1=O)(C(F)(F)F)O
IUPAC Name4-hydroxy-4-(trifluoromethyl)cyclohexan-1-one
InChIKeyWQEVHVUXWMPHQO-UHFFFAOYSA-N
INCHI1S/C7H9F3O2/c8-7(9,10)6(12)3-1-5(11)2-4-6/h12H,1-4H2
SMILES isoméricas C1CC(CCC1=O)(C(F)(F)F)O
CAS alternativo 120929-90-0
PubChem CID 20035142
Peso molecular 182.14

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
ClasseOrganooxygen compounds
SubclassAlcohols and polyols
Intermediate Tree Nodes Not available
Direct ParentTertiary alcohols
Alternative Parents Cyclic ketones  Cyclic alcohols and derivatives  Organofluorides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents Tertiary alcohol - Cyclic alcohol - Cyclic ketone - Ketone - Organic oxide - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound
DescriçãoThis 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
Estrutura 3D
Modelo de Estrutura Química Interativa





Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriedades químicas e físicas
Peso molecular182.140 g/mol
XLogP30.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass182.055 Da
Monoisotopic Mass182.055 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count12
Formal Charge0
Complexity187.000
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
Calculadoras de soluções
Revisões

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