Basic information Application Safety Supplier Related

4,4'-BICYCLOHEXANOL

Basic information Application Safety Supplier Related

4,4'-BICYCLOHEXANOL Basic information

Product Name:
4,4'-BICYCLOHEXANOL
Synonyms:
  • 4,4'-BICYCLOHEXANEDIOL
  • 4,4'-BICYCLOHEXANOL
  • 4,4'-BICYCLOHEXYLDIOL
  • 4,4'-DIHYDROXYBICYCLOHEXYL
  • 4,4'-DIHYDROXYDICYCLOHEXYL
  • 4,4'-DICYCLOHEXYLDIOL
  • 4,4'-BICYCLOHEXYLDIOL (CIS+TRANS), MIXTURE OF ISOMERS
  • 4,4''-BICYCLOHEXANOL 98+%
CAS:
20601-38-1
MF:
C12H22O2
MW:
198.3
EINECS:
243-908-4
Product Categories:
  • LCD
Mol File:
20601-38-1.mol
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4,4'-BICYCLOHEXANOL Chemical Properties

Melting point:
184-188 °C
Boiling point:
324.2±10.0 °C(Predicted)
Density 
1.098±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
form 
powder to crystal
pka
14.99±0.40(Predicted)
color 
White to Almost white
InChI
InChI=1S/C12H22O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h9-14H,1-8H2
InChIKey
MZXNOAWIRQFYDB-UHFFFAOYSA-N
SMILES
C1(C2CCC(O)CC2)CCC(O)CC1
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-36
WGK Germany 
3
HS Code 
2906190090

MSDS

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4,4'-BICYCLOHEXANOL Usage And Synthesis

Application

4,4'-Dihydroxydicyclohexane is a hydrocarbon organic compound that can be used as an intermediate in the synthesis of materials.

Chemical Properties

white powder

Synthesis

92-88-6

20601-38-1

The general procedure for the synthesis of 4,4'-dihydroxydicyclohexane from 4,4'-dihydroxybiphenyl was as follows: in a 300 mL autoclave equipped with a stirring device, 20 g of 4,4'-biphenol, 1 g of Ruanne nickel and 80 g of 2-propanol were added. The hydrogenation reaction was carried out under hydrogen atmosphere at 6 MPa pressure and 150 °C temperature for 2 hours. Upon completion of the reaction, 2-propanol was added to the reaction solution until the crystals were completely dissolved. Subsequently, the catalyst was removed by filtration to obtain a pure reaction product solution. Finally, the solution was processed by concentration and drying to obtain 21.4 g of crude 4,4'-bicyclohexanol (A) with a purity of 96.7%.

References

[1] Chemistry - A European Journal, 2009, vol. 15, # 28, p. 6953 - 6963
[2] Collection of Czechoslovak Chemical Communications, 1974, vol. 39, p. 249 - 256
[3] Patent: US4910350, 1990, A
[4] Patent: EP2837615, 2015, A1. Location in patent: Paragraph 0045
[5] Advanced Synthesis and Catalysis, 2018, vol. 360, # 20, p. 3924 - 3929

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