Chemical Properties of 2-Propanone, 1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)- (CAS 4899-74-5)

2-Propanone, 1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-

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InChI
InChI=1S/C10H12O4/c1-14-10-5-7(2-3-9(10)13)4-8(12)6-11/h2-3,5,11,13H,4,6H2,1H3
InChI Key
CSQGINGXEBQJPA-UHFFFAOYSA-N
Formula
C10H12O4
SMILES
COc1cc(CC(=O)CO)ccc1O
Molecular Weight1
196.20
CAS
4899-74-5
Other Names
  • 1-Hydroxy-3-(4-hydroxy-3-methoxyphenyl)propan-2-one
Sources

Physical Properties

Property Value Unit Source
Δf -389.26 kJ/mol Joback Calculated Property
Δfgas -599.01 kJ/mol Joback Calculated Property
Δfus 27.97 kJ/mol Joback Calculated Property
Δvap 79.64 kJ/mol Joback Calculated Property
logPoct/wat 0.50 Crippen Calculated Property
Pc 4031.24 kPa Joback Calculated Property
Tboil 708.95 K Joback Calculated Property
Tc 917.59 K Joback Calculated Property
Tfus 486.10 K Joback Calculated Property
Vc 0.50 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 394.98 J/mol×K 708.95 Joback Calculated Property
η 0.00 Pa×s 708.95 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2-Propanone, 1-(4-hydroxy-3-methoxyphenyl)-. 3,4-Dimethoxyphenylacetone. Dihydroconiferyl alcohol. 1-(4-hydroxy-3,5-dimethoxyphenyl)-2-propanone. 3-(3,4-Dimethoxyphenyl)-1-propanol. «beta»-(4-Hydroxy-3-methoxyphenyl)propionic acid. Phenol, 2-methoxy-4-propyl-. Homovanillin. 3,4-Methylenedioxyphenyl acetone. zingerol. Propanal, 3-(4-hydroxy-3-methoxyphenyl). Dihydrosinapyl alcohol. 3-(3,4-Dimethoxyphenyl)-propionic acid. 1,2-Dimethoxy-4-N-propylbenzene. 4-(4-hydroxy-3-methoxyphenyl)-1-butanol.

Find more compounds similar to 2-Propanone, 1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-.

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