2-Cyclohexylphenol

Basic Information

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CAS Number

119-42-6

Molecular Formula

C12H16O

Molecular Weight

176.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

55.0 to 59.0 deg-C

Boiling Point

284°C

Flash Point

134℃

Refractive Index

1.5415 (estimate)

Vapor Pressure

0.0±0.5 mmHg at 25°C

SMILES

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C1CCC(CC1)C2=CC=CC=C2O

InChI

InChI=1S/C12H16O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h4-5,8-10,13H,1-3,6-7H2

InChIKey

MVRPPTGLVPEMPI-UHFFFAOYSA-N

LogP

3.4399000000000015

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

149

Safety Information

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Hazard Statement

Synonyms & References

English

ortho cyclohexyl phenol
AKOS006229573
SCHEMBL55659
Phenol, o-cyclohexyl-
Phenol, 2-cyclohexyl-
DTXSID2059487
CS-0206891
NSC-6093
119-42-6
W-109438
KIR1PB30LI
NSC 6093
UNII-KIR1PB30LI
NSC6093
Phenol,2-cyclohexyl-
EINECS 204-322-4
D89289
CYCLOHEXYLPHENOL
o-Cyclohexylphenol
CHEMBL1812771
AI3-09047
o-cyclohexyl phenol
FT-0631681
2-CYCLOHEXYLPHENOL
A804280
A20144
2-cyclohexyl-phenol
Q27282273
AS-57038
MFCD00019335
2-Hydroxyphenylcyclohexane

MDL Number

MFCD00019335

Customs Code

2907199090

FAQ

What are the physical and chemical properties of 2-Cyclohexylphenol (CAS: 119-42-6)?

2-Cyclohexylphenol is a white crystalline solid with a molecular weight of approximately 174.26 g/mol. It has a slight phenolic odor and is slightly soluble in water but more soluble in organic solvents. It is moderately reactive towards bases and can undergo various chemical transformations including esterification and condensation reactions.

How is 2-Cyclohexylphenol (CAS: 119-42-6) typically synthesized?

2-Cyclohexylphenol can be synthesized via the reduction of 2-cyclohexylphenone using a catalytic amount of palladium on carbon or by hydrogenation of the corresponding ketone. The reaction is typically performed in an inert atmosphere to prevent oxidation and yields a high purity product with selectivity towards the alcohol isomer.

What industries use 2-Cyclohexylphenol (CAS: 119-42-6)?

2-Cyclohexylphenol is used in the pharmaceutical industry as a precursor for the synthesis of various drugs, including analgesics and antipyretics. It is also utilized in the polymer industry for producing plasticizers and in the sensor industry for the development of gas-sensitive materials.

What precautions should be taken when handling 2-Cyclohexylphenol (CAS: 119-42-6)?

When handling 2-Cyclohexylphenol, it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. Ensure the use of a fume hood during operations to minimize inhalation risk. Store in a cool, well-ventilated area away from heat and ignition sources. In case of spill, neutralize with an appropriate absorbent and consult a safety data sheet (SDS) for further instructions.