Chemical Properties of Valerophenone (CAS 1009-14-9)

Valerophenone

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InChI
InChI=1S/C11H14O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3
InChI Key
XKGLSKVNOSHTAD-UHFFFAOYSA-N
Formula
C11H14O
SMILES
CCCCC(=O)c1ccccc1
Molecular Weight1
162.23
CAS
1009-14-9
Other Names
  • 1-Phenyl-1-pentanone
  • Butyl phenyl ketone
  • Pentanophenone
  • Valerophenone
Sources

Physical Properties

Property Value Unit Source
Δf 25.23 kJ/mol Joback Calculated Property
Δfgas -146.42 kJ/mol Joback Calculated Property
Δfus 19.89 kJ/mol Joback Calculated Property
Δvap 49.10 kJ/mol Joback Calculated Property
IE 9.30 eV NIST
logPoct/wat 3.060 Crippen Calculated Property
Pc 2829.33 kPa Joback Calculated Property
Tboil 379.20 K NIST
Tc 743.09 K Joback Calculated Property
Tfus 290.08 K Joback Calculated Property
Vc 0.549 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 321.62 J/mol×K 531.63 Joback Calculated Property
η 0.0002437 Pa×s 531.63 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 1
-CH2- 3
>C=O (nonring) 1
-CH3 1
=CH- (ring) 5

Similar Compounds

1-Hexanone, 1-phenyl-. Isocaprophenone. Heptanophenone. 1,4-Dibenzoyl-butane. Octadecanophenone. Pentadecanophenone. DODECANOPHENONE. 1-Phenylnonan-1-one. n-Undecanophenone. HEXADECANOPHENONE. 1-Octanone, 1-phenyl-. 1-Decanone, 1-phenyl-. Tetradecanophenone. 1-Butanone, 1-phenyl-. 4-METHYL-1-PENTANOYLBENZENE.

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