4-(Trifluoromethyl)cyclohexanecarboxylic Acid

Basic Information

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CAS Number

95233-30-0

Molecular Formula

C8H11F3O2

Molecular Weight

196.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Specialty Chemicals UV Stabilizers

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

71-75 °C

Boiling Point

230-231°C

Density

1.292

Flash Point

95°C

Refractive Index

1.421

SMILES

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C1CC(CCC1C(=O)O)C(F)(F)F

InChI

InChI=1S/C8H11F3O2/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h5-6H,1-4H2,(H,12,13)

InChIKey

LMEAZIIFLVDISW-UHFFFAOYSA-N

LogP

2.439700000000001

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

192

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class CORROSIVE Class CORROSIVE

Synonyms & References

English

4-(Trifluoromethyl)cyclohexanecarboxylic Acid (cis- and trans- mixture)
4-(Trifluoromethyl)cyclohexan-1-carboxylic acid
4-(TRIFLUOROMETHYL)CYCLOHEXANE-1-CARBOXYLIC ACID
Cyclohexanecarboxylic acid, 4-(trifluoromethyl)-
4-trifluoromethyl CCA
4-trifluoromethylcyclohexan-1-one
4-Trifluoromethylcyclohexane-1-carboxylic Acid
trans-4-trifluoromethylcyclohexane carboxylic acid
4-(Trifluoromethyl)cyclohexanecarboxylicacid
4-(Trifluoromethyl)Cyclohexanecarboxylic Acid, Cis + Trans
4-(Trifluoromethyl)cyclohexanecarboxylic Acid
trans-4-(Trifluoromethyl)cyclohexanecarboxylic Acid
cis-4-(Trifluoromethyl)cyclohexanecarboxylic Acid
(1R,4R)-4-(Trifluoromethyl)cyclohexanecarboxylic acid
trans-4-(Trifluoromethyl)cyclohexane-carboxylicacid
trans-4-(Trifluoromethyl)cyclohexane-carboxylic acid
Cyclohexanecarboxylic acid, 4-(trifluoromethyl)-, trans-
TR
4-(Trifluoromethyl)cyclohexanecarboxylic acid (ACI)
4-Trifluoromethylcyclohexane-1-carboxylic acid
4-(trifluoromethyl)cyclohexanecarboxylic acid
CS-0056098
(1r,4r)-4-(trifluoromethyl)cyclohexane-1-carboxylic acid
NRKORHASVPIHNO-UHFFFAOYSA-N
AKOS037646315
AKOS005256951
Z316121942
DB-057568
cis-4-(Trifluoromethyl)cyclohexane-1-carboxylic acid
SCHEMBL671388
trans-4-(Trifluoromethyl)cyclohexanecarboxylic acid, 96%

MDL Number

MFCD00220049

Customs Code

2916209090

FAQ

What regulatory guidelines apply to 4-(Trifluoromethyl)cyclohexanecarboxylic Acid (CAS: 95233-30-0)?

4-(Trifluoromethyl)cyclohexanecarboxylic Acid (CAS: 95233-30-0) should adhere to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the EU, and FDA/EPA guidelines for chemical safety. It is classified as a hazardous chemical due to its flammability and health hazards, requiring appropriate labeling, storage, and handling procedures.

Are there alternatives to 4-(Trifluoromethyl)cyclohexanecarboxylic Acid (CAS: 95233-30-0) in synthesis?

Alternatives to 4-(Trifluoromethyl)cyclohexanecarboxylic Acid include other carboxylic acids with different substituents, such as 2,4,5-trifluorobenzoic acid and 3,4,5-trifluorobenzoic acid. These can be used as substitutes in similar synthetic protocols, providing similar functionalities with varying physical properties and reactivity.

What is the market or research trend for 4-(Trifluoromethyl)cyclohexanecarboxylic Acid (CAS: 95233-30-0)?

The market for 4-(Trifluoromethyl)cyclohexanecarboxylic Acid is growing due to its use in pharmaceuticals and materials science for functionalizing polymers and developing drug candidates. Research trends focus on its application in medicinal chemistry and as a versatile building block in organic synthesis, with increasing demand from academic and industrial sectors.

How should waste containing 4-(Trifluoromethyl)cyclohexanecarboxylic Acid (CAS: 95233-30-0) be handled?

Waste containing 4-(Trifluoromethyl)cyclohexanecarboxylic Acid should be collected in a sealed container, labeled appropriately, and disposed of according to local regulations. Incineration or professional waste disposal services are recommended. Ensure proper ventilation and protective measures are in place to minimize exposure and environmental impact during handling and disposal.