Chemical Properties of 3-(4-Hydroxyphenyl)propionitrile (CAS 17362-17-3)

3-(4-Hydroxyphenyl)propionitrile

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InChI
InChI=1S/C9H9NO/c10-7-1-2-8-3-5-9(11)6-4-8/h3-6,11H,1-2H2
InChI Key
KDMJGLYRWRHKJS-UHFFFAOYSA-N
Formula
C9H9NO
SMILES
N#CCCc1ccc(O)cc1
Molecular Weight1
147.17
CAS
17362-17-3
Other Names
  • 3-(p-Hydroxyphenyl)propiononitrile
  • Benzenepropanenitrile, 4-hydroxy-
  • «beta»-(4-Hydroxyphenyl)propionitrile
Sources

Physical Properties

Property Value Unit Source
Δf 115.87 kJ/mol Joback Calculated Property
Δfgas -4.99 kJ/mol Joback Calculated Property
Δfus 20.40 kJ/mol Joback Calculated Property
Δvap 61.40 kJ/mol Joback Calculated Property
logPoct/wat 1.85 Crippen Calculated Property
Pc 3777.68 kPa Joback Calculated Property
Tboil 614.70 K Joback Calculated Property
Tc 852.69 K Joback Calculated Property
Tfus 394.32 K Joback Calculated Property
Vc 0.42 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 287.94 J/mol×K 614.7 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-CN 1
-CH2- 2
=C< (ring) 2
-OH (phenol) 1
=CH- (ring) 4

Similar Compounds

Phenol, 4-propyl-. Phenol, p-propyl-. Phenol, 4-butyl-. .BETA.(p-methoxyphenyl)propionitrile. 4-Iso butylphenol. 3-(4-Hydroxyphenyl)propanal. 4-PENTYL-PHENOL. Phenol, 4-ethyl-. 4-hexylphenol. Phenol, 4-(1-methylpropyl)-. Phenol, p-(2-methylallyl)-. 4-Propylanisole. Phenol, 4-heptyl-. 2-Propanamine, 1-(4-hydroxyphenyl)-, hydrobromide. Paradrine.

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