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61204-03-3

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Basic Information
CAS No.: 61204-03-3
Name: trans-4-(4-Heptylcyclohexyl)benzonitrile
Article Data: 3
Molecular Structure:
Molecular Structure of 61204-03-3 (trans-4-(4-Heptylcyclohexyl)benzonitrile)
Formula: C20H29 N
Molecular Weight: 283.457
Synonyms: Benzonitrile,4-(4-heptylcyclohexyl)-, trans-; 4-(trans-4-Heptylcyclohexyl)benzonitrile;4-(trans-4-n-Heptylcyclohexyl)benzonitrile;4-(trans-4'-n-Heptylcyclohexyl)-1-cyanobenzene; 7PCH; Licristal S 1115; PCH 7;S 1115; p-trans-4-Heptylcyclohexylbenzonitrile;trans-4-Heptyl(4-cyanophenyl)cyclohexane;trans-4-Heptyl-1-(4-cyanophenyl)cyclohexane
EINECS: 262-658-7
Density: 0.96g/cm3
Melting Point: 33℃
Boiling Point: 409.2°C at 760 mmHg
Flash Point: 202.6°C
Solubility: Slightly soluble in water.
PSA: 23.79000
LogP: 6.19258
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Chemistry

Molecular Structure of trans-4-(4-Heptylcyclohexyl)benzonitrile (CAS NO.61204-03-3):

IUPAC Name: 4-(4-Heptylcyclohexyl)benzonitrile 
Molecular Formula: C20H29N
Molecular Weight: 283.45
EINECS: 262-658-7 
Index of Refraction: 1.518
Molar Refractivity: 89.42 cm3
Molar Volume: 295 cm3
Surface Tension: 39.2 dyne/cm
Density: 0.96 g/cm3
Flash Point: 202.6 °C
Enthalpy of Vaporization: 66.14 kJ/mol
Boiling Point: 409.2 °C at 760 mmHg
Vapour Pressure: 6.6E-07 mmHg at 25 °C
Canonical SMILES: CCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C#N
InChI: InChI=1S/C20H29N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h10-11,14-15,17,19H,2-9,12-13H2,1H3
InChIKey: NSGMZTNTQKRAFA-UHFFFAOYSA-N

Uses

 trans-4-(4-Heptylcyclohexyl)benzonitrile (CAS NO.61204-03-3) is used as intermediates of liquid crystals.

Specification

 trans-4-(4-Heptylcyclohexyl)benzonitrile (CAS NO.61204-03-3), its Synonyms are Benzonitrile,4-(trans-4-heptylcyclohexyl)- ; trans-4-Heptyl(4-cyanophenyl)cyclohexane ; Benzonitrile,4-(4-heptylcyclohexyl)-, trans- ; 4-(trans-4-Heptylcyclohexyl)benzonitrile ; 4-(trans-4-n-Heptylcyclohexyl)benzonitrile ; 4-(trans-4'-n-Heptylcyclohexyl)-1-cyanobenzene ; 7PCH ; Licristal S 1115 ; PCH 7; S 1115 ; p-trans-4-Heptylcyclohexylbenzonitrile ; trans-4-Heptyl(4-cyanophenyl)cyclohexane ; trans-4-Heptyl-1-(4-cyanophenyl)cyclohexane .