Chemical Properties of 1-(2,4,5-Trimethoxyphenyl)propan-2-one (CAS 2020-90-8)

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

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C12H16O4/c1-8(13)5-9-6-11(15-3)12(16-4)7-10(9)14-2/h6-7H,5H2,1-4H3
InChI Key
AQZHZTTUVYQMIN-UHFFFAOYSA-N
Formula
C12H16O4
SMILES
COc1cc(OC)c(OC)cc1CC(C)=O
Molecular Weight1
224.25
CAS
2020-90-8
Sources

Physical Properties

Property Value Unit Source
Δf -310.24 kJ/mol Joback Calculated Property
Δfgas -598.13 kJ/mol Joback Calculated Property
Δfus 24.87 kJ/mol Joback Calculated Property
Δvap 60.54 kJ/mol Joback Calculated Property
logPoct/wat 1.84 Crippen Calculated Property
Pc 2329.27 kPa Joback Calculated Property
Tboil 636.71 K Joback Calculated Property
Tc 841.45 K Joback Calculated Property
Tfus 405.60 K Joback Calculated Property
Vc 0.66 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 443.68 J/mol×K 636.71 Joback Calculated Property
η 0.00 Pa×s 636.71 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2-Propanone, (2,5-dimethoxy)phenyl-. Benzeneethanamine,2,4,5-trimethoxy-«alpha»-methyl-(.+/-.)-. Phenethylamine, 2,4,5-trimethoxy-«alpha»-methyl-. Tatarinoid B. .gamma.-Asarone. 2-Propanone, 1-(4-hydroxy-2,6-dimethoxyphenyl). 1-(2,4,5-Trimethoxyphenyl)propan-1-one. 4,5-METHYLENEDIOXYAMPHETAMINE, 2-METHOXY-. 2,3,4-Trimethoxyphenylacetic acid. 1-(4-hydroxy-3,5-dimethoxyphenyl)-2-propanone. 3,4-Dimethoxyphenylacetone. 1-(2,4,5-Trimethoxyphenyl)butan-1-one. Fenproporex-M (desamino-oxo-HO-methoxy), AC. 4-Methoxysafrole. Benzene, 1,2,3,4-tetramethoxy-5-(2-propenyl)-.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.