4,4-Difluorocyclohexanecarboxylic acid

Basic Information

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CAS Number

122665-97-8

Molecular Formula

C7H10F2O2

Molecular Weight

164.15 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

103-107 °C

Boiling Point

241.1 °C at 760 mmHg

Density

1.24

Flash Point

99.6℃

Refractive Index

1.443

SMILES

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

InChI

InChI=1S/C7H10F2O2/c8-7(9)3-1-5(2-4-7)6(10)11/h5H,1-4H2,(H,10,11)

InChIKey

HYIUDFLDFSIXTR-UHFFFAOYSA-N

LogP

1.8965

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

158

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

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

4,4-difluoro-cyclohexanecarboxylic acid
4,4-difluorocyclohexanoic acid
4,4-Difluorocyclohexylcarboxylic acid
4,4-difluorocyclohexane carboxylic acid
4,4-Difluorocyclohexanecarboxylicacid
BCP21700
122665-97-8
SY017995
C7H10F2O2
AKOS005063373
MFCD03788493
EN300-69578
A2584
PB26085
AM20070528
FT-0617049
4,4-Difluorocyclohexanecarboxylic acid, 97%
CS-D1695
H-20299
AC-338
DTXSID00381285
SCHEMBL18199
cyclohexanecarboxylic acid, 4,4-difluoro-
J-514001
4,4-difluoro-cyclohexane carboxylic acid
4,4-difluorocyclohexane-1-carboxylic Acid
D4330
VS523UUG56
4,4-Difluorocyclohexanecarboxylic acid
J-004842
HXFA

MDL Number

MFCD03788493

Customs Code

2916209090

FAQ

What is 4,4-Difluorocyclohexanecarboxylic acid (CAS: 122665-97-8)?

4,4-Difluorocyclohexanecarboxylic acid is an organic compound with the chemical formula C8H12F2O2. It is a cyclohexane derivative featuring two fluorine atoms at the 4-position and a carboxylic acid group. The compound is typically a white to pale yellow solid with a characteristic odor. It is known for its stability under normal conditions and is used in various chemical applications.

What are the main uses of 4,4-Difluorocyclohexanecarboxylic acid (CAS: 122665-97-8)?

4,4-Difluorocyclohexanecarboxylic acid is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in the synthesis of fluorinated organic compounds, which are valuable in agrochemicals and materials science. Additionally, it is used in the production of specialty chemicals and as an intermediate in organic reactions.

Is 4,4-Difluorocyclohexanecarboxylic acid (CAS: 122665-97-8) safe?

4,4-Difluorocyclohexanecarboxylic acid is generally considered safe when handled properly. However, it should be treated with caution as it may cause skin and eye irritation. Safety data sheets recommend using appropriate personal protective equipment (PPE) such as gloves and goggles. It is important to follow safety standards and avoid inhalation or ingestion to ensure safe handling.

How should 4,4-Difluorocyclohexanecarboxylic acid (CAS: 122665-97-8) be stored?

4,4-Difluorocyclohexanecarboxylic acid should be stored in a cool, dry, and well-ventilated area, away from direct light. It is best kept in a sealed container at a temperature below 25°C to maintain stability. Avoid exposure to moisture and incompatible substances to ensure safe storage conditions.