Molecular Structure of 4-(Hexyloxy)phenyl 4-butylbenzoate (CAS No.38454-28-3):
Molecular Formula: C23H30O3
Molecular Weight: 354.4825
CAS No: 38454-28-3
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 12
Polar Surface Area: 35.53 Å2
Index of Refraction: 1.529
Molar Refractivity: 106.55 cm3
Molar Volume: 345.2 cm3
Surface Tension: 37.8 dyne/cm
Density: 1.026 g/cm3
Flash Point: 206.7 °C
Enthalpy of Vaporization: 74.39 kJ/mol
Boiling Point: 479.6 °C at 760 mmHg
Vapour Pressure: 2.34E-09 mmHg at 25°C
IUPAC Name: (4-Hexoxyphenyl) 4-butylbenzoate
InChI: InChI=1/C23H30O3/c1-3-5-7-8-18-25-21-14-16-22(17-15-21)26-23(24)20-12-10-19(11-13-20)9-6-4-2/h10-17H,3-9,18H2,1-2H3
InChIKey: QZYDWVAYBOXUCW-UHFFFAOYAY
Std. InChI: InChI=1S/C23H30O3/c1-3-5-7-8-18-25-21-14-16-22(17-15-21)26-23(24)20-12-10-19(11-13-20)9-6-4-2/h10-17H,3-9,18H2,1-2H3
Std. InChIKey: QZYDWVAYBOXUCW-UHFFFAOYSA-N
Product Categories: Functional Materials;Liquid Crystals Related Compounds;Phenyl Esters (Liquid Crystals)
4-(Hexyloxy)phenyl 4-butylbenzoate (CAS No.38454-28-3), its synonyms are Benzoic acid, 4-butyl-, 4-(hexyloxy)phenyl ester ; 4-Butylbenzoic acid 4-(hexyloxy)phenyl ester ; p-(Hexyloxy)phenyl p-butylbenzoate .
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