Chemical Properties of Acetophenone, 2,4,5-trihydroxy (CAS 1818-27-5)

Acetophenone, 2,4,5-trihydroxy

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

InChI
InChI=1S/C8H8O4/c1-4(9)5-2-7(11)8(12)3-6(5)10/h2-3,10-12H,1H3
InChI Key
WCJLAYDOJJYRHF-UHFFFAOYSA-N
Formula
C8H8O4
SMILES
CC(=O)c1cc(O)c(O)cc1O
Molecular Weight1
168.15
CAS
1818-27-5
Sources

Physical Properties

Property Value Unit Source
Δf -463.89 kJ/mol Joback Calculated Property
Δfgas -616.43 kJ/mol Joback Calculated Property
Δfus 29.46 kJ/mol Joback Calculated Property
Δvap 81.47 kJ/mol Joback Calculated Property
logPoct/wat 1.01 Crippen Calculated Property
Pc 7627.62 kPa Joback Calculated Property
Tboil 704.85 K Joback Calculated Property
Tc 958.07 K Joback Calculated Property
Tfus 591.43 K Joback Calculated Property
Vc 0.28 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 314.57 J/mol×K 704.85 Joback Calculated Property
η 0.00 Pa×s 704.85 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Ethanone, 1-(2,3,4-trihydroxyphenyl)-. Acetophenone, 2,3,4-trihydroxy-. Ethanone, 1-(2,5-dihydroxyphenyl)-. 1-Butanone, 1-(2,4,5-trihydroxyphenyl)-. Ethanone, 1-(2,4-dihydroxyphenyl)-. 2,3-dihydroxyacetophenone. Ethanone, 1-(2,4,6-trihydroxyphenyl)-. 3,4-Dihydroxyacetophenone. 2',5'-Dihydroxypropiophenone. Ethanone, 1-(2-hydroxy-4-methoxyphenyl)-. Ethanone, 1-(2-hydroxy-5-methoxyphenyl)-. Flopropione. Ethanone, 1-(2,6-dihydroxy-4-methoxyphenyl)-. Resorcinol, 2-acetyl-. 3',4'-Dihydroxybutyrophenone.

Find more compounds similar to Acetophenone, 2,4,5-trihydroxy.

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.