Chemical Properties of 4-Acetoxy-3-methoxyacetophenone (CAS 54771-60-7)

4-Acetoxy-3-methoxyacetophenone

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InChI
InChI=1S/C11H12O4/c1-7(12)9-4-5-10(15-8(2)13)11(6-9)14-3/h4-6H,1-3H3
InChI Key
GCVAEUQDYWOLCF-UHFFFAOYSA-N
Formula
C11H12O4
SMILES
COc1cc(C(C)=O)ccc1OC(C)=O
Molecular Weight1
208.21
CAS
54771-60-7
Other Names
  • 4'-Hydroxy-3'-methoxyacetophenone, acetate
  • 4-Acetyl-2-methoxyphenyl acetate
  • Acetovanillone acetate
  • Phenol, 4-acetyl-2-methoxy, acetate
Sources

Physical Properties

Property Value Unit Source
Δf -332.95 kJ/mol Joback Calculated Property
Δfgas -546.38 kJ/mol Joback Calculated Property
Δfus 23.08 kJ/mol Joback Calculated Property
Δvap 61.99 kJ/mol Joback Calculated Property
logPoct/wat 1.82 Crippen Calculated Property
Pc 2826.33 kPa Joback Calculated Property
Tboil 640.30 K Joback Calculated Property
Tc 856.49 K Joback Calculated Property
Tfus 409.51 K Joback Calculated Property
Vc 0.59 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 385.86 J/mol×K 640.3 Joback Calculated Property
η 0.00 Pa×s 640.3 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=C< (ring) 3
>C=O (nonring) 2
-CH3 3
=CH- (ring) 3

Similar Compounds

Vanillin, acetate. Ethanone, 1-(3,4-dimethoxyphenyl)-. Ethanone, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-. 3-Hydroxy-4-methoxybenzaldehyde, acetate. Phenol, 2-methoxy-4-(2-propenyl)-, acetate. Dihydro-eugenol acetate. 4-Tert-butyl-o-phenylene diacetate. 1,2-Diacetoxy-4-allylbenzene. Apocynin. Acetylvanillone. Propiophenone, 3',4'-dimethoxy-. Ethanone, 1-(3,4,5-trimethoxyphenyl)-. R,S-4'-Methoxy-«alpha»-pyrrolidinopropiophenone-M (desmethyl-3-methoxy-desamino-oxo-), ethylated. 1-(4-Acetoxy-3-methoxyphenyl)-2-propanone. R,S-3',4'-methylenedioxy-«alpha»-pyrrolidinopropiophenone-M (desmethylene-desamino-oxo-), diethylated.

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