(1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl)

Basic Information

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CAS Number

118164-51-5

Molecular Formula

C23H34F2

Molecular Weight

348.52 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

46.0 to 50.0 deg-C

Boiling Point

415.5±38.0 °C at 760 mmHg

Water Solubility

Slightly soluble in water.

Flash Point

173.7±14.6 °C

SMILES

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CCCCCC1CCC(CC1)C2CCC(CC2)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C23H34F2/c1-2-3-4-5-17-6-8-18(9-7-17)19-10-12-20(13-11-19)21-14-15-22(24)23(25)16-21/h14-20H,2-13H2,1H3/t17-,18-,19-,20-

InChIKey

YDVUSMRUBCJGAV-UBBSCCEASA-N

LogP

7.625300000000006

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

366

Synonyms & References

English

SCHEMBL548953
SCHEMBL548952
118164-51-5
TRANS,TRANS-4-(3,4-DIFLUOROPHENYL)-4''-PENTYLBICYCLOHEXYL
trans,trans-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexane)
SCHEMBL548954
SCHEMBL12314615
A803890
MFCD13182310
DTXSID00342417
TRANS,TRANS-4-(3,4-DIFLUOROPHENYL)-4'-N-PENTYLBICYCLOHEXYL
TL205
CS-W009815
Benzene,1,2-difluoro-4-[(trans,trans)-4'-pentyl[1,1'-bicyclohexyl]-4-yl]-
AKOS015999142
D4798
4-[(Trans,trans)-4'-pentyl[1,1'-bicyclohexyl] -4-yl]-1,2-difluorobenzene
1923051-56-2
4-(3,4-DIFLUOROPHENYL)-4'-PENTYL-1,1'-BI(CYCLOHEXANE)
Benzene, 1,2-difluoro-4-(4'-pentyl[1,1'-bicyclohexyl]-4-yl)-
trans,trans-4-(3,4-Difluorophenyl)-4'-pentylbicyclohexyl
C23H34F2
TRANS,TRANS-4-(3,4-DIFLUOROPHENYL)-4-PENTYLBICYCLOHEXYL
SCHEMBL2959381
SCHEMBL9348199
AKOS024462411
trans,trans-4-(3,4-Difluorophenyl)-4'-Pentylbicyclohexane
3~3~,3~4~-Difluoro-1~4~-pentyl-1~1~,1~2~,1~3~,1~4~,1~5~,1~6~,2~1~,2~2~,2~3~,2~4~,2~5~,2~6~-dodecahydro-1~1~,2~1~:2~4~,3~1~-terphenyl
J-513353
FT-0656297
1,2-difluoro-4-[4-(4-pentylcyclohexyl)cyclohexyl]benzene

MDL Number

MFCD13182310

Customs Code

2903999090

FAQ

What are the physical and chemical properties of (1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl) (CAS: 118164-51-5)?

(1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl) is a crystalline compound with a molecular weight of approximately 353.35 g/mol. It has low solubility in water but is soluble in organic solvents like dichloromethane and toluene. The compound is generally stable but may react with strong oxidizing agents. It is used in various applications due to its chemical stability and specific substituent groups.

How is (1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl) (CAS: 118164-51-5) typically synthesized?

(1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl) is synthesized via a multistep process involving Friedel-Crafts alkylation and ring closure. Commonly, a fluoroaromatic compound is reacted with cyclohexene in the presence of a Lewis acid catalyst. The yield and selectivity of the reaction are influenced by the choice of catalyst and reaction conditions. The process typically involves careful temperature control and use of appropriate solvents.

What industries use (1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl) (CAS: 118164-51-5)?

(1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl) finds applications in the pharmaceutical industry for its potential in drug synthesis. It is also used in polymer manufacturing due to its stability and specific substituent groups. Additionally, its chemical properties make it suitable for use in sensor technology and semiconductor industries.

What precautions should be taken when handling (1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl) (CAS: 118164-51-5)?

When handling (1r,1's,4r,4'R)-4-(3,4-Difluorophenyl)-4'-pentyl-1,1'-bi(cyclohexyl), standard personal protective equipment (PPE) such as gloves, goggles, and a lab coat should be worn. Operations should be conducted in a well-ventilated area or fume hood to prevent inhalation of potential fumes. Spills should be immediately contained and cleaned up using appropriate absorbents. Always refer to the Safety Data Sheet (SDS) for specific handling and disposal instructions.