Chemical Properties of 1-(2,4,5-Trimethoxyphenyl)butan-1-one (CAS 2020-73-7)

1-(2,4,5-Trimethoxyphenyl)butan-1-one

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InChI
InChI=1S/C13H18O4/c1-5-6-10(14)9-7-12(16-3)13(17-4)8-11(9)15-2/h7-8H,5-6H2,1-4H3
InChI Key
CSBSTMGRAOUNFM-UHFFFAOYSA-N
Formula
C13H18O4
SMILES
CCCC(=O)c1cc(OC)c(OC)cc1OC
Molecular Weight1
238.28
CAS
2020-73-7
Sources

Physical Properties

Property Value Unit Source
Δf -301.82 kJ/mol Joback Calculated Property
Δfgas -618.77 kJ/mol Joback Calculated Property
Δfus 27.46 kJ/mol Joback Calculated Property
Δvap 62.77 kJ/mol Joback Calculated Property
logPoct/wat 2.70 Crippen Calculated Property
Pc 2127.56 kPa Joback Calculated Property
Tboil 659.59 K Joback Calculated Property
Tc 861.54 K Joback Calculated Property
Tfus 416.87 K Joback Calculated Property
Vc 0.72 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 494.68 J/mol×K 659.59 Joback Calculated Property
η 0.00 Pa×s 659.59 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 3
-CH3 4
=CH- (ring) 2
=C< (ring) 4
-CH2- 2
>C=O (nonring) 1

Similar Compounds

1-(2,4,5-Trimethoxyphenyl)propan-1-one. 2-hydroxyl-3,4,6-trimethoxy-acetophenone. 2,3,4,6-tetramethoxy-acetophenone. 2-hydroxyl-tetramethoxy-acetophenone. 2',3',4' Trimethoxyacetophenone. 2',5'-Dimethoxypropiophenone. 2,5-Dibutyroxy-4-hydroxy butyrophenone. 1-Propanone, 1-(2,4-dimethoxyphenyl)-. 1-Butanone, 1-(2,4,5-trihydroxyphenyl)-. Buflomedil. 1-(2,4,5-Trimethoxyphenyl)propan-2-one. Isopropyl 3,4,5-trimethoxyphenyl ketone. Butyrovanillone. Phloretin, tetramethyl ether. Torquatone.

Find more compounds similar to 1-(2,4,5-Trimethoxyphenyl)butan-1-one.

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