Chemical Properties of 1-(3,4-Dimethoxyphenyl)pentan-3-one (CAS 39728-56-8)

1-(3,4-Dimethoxyphenyl)pentan-3-one

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InChI
InChI=1S/C13H18O3/c1-4-11(14)7-5-10-6-8-12(15-2)13(9-10)16-3/h6,8-9H,4-5,7H2,1-3H3
InChI Key
SOWKMIKWOOVRAB-UHFFFAOYSA-N
Formula
C13H18O3
SMILES
CCC(=O)CCc1ccc(OC)c(OC)c1
Molecular Weight1
222.28
CAS
39728-56-8
Sources

Physical Properties

Property Value Unit Source
Δf -187.19 kJ/mol Joback Calculated Property
Δfgas -475.08 kJ/mol Joback Calculated Property
Δfus 26.66 kJ/mol Joback Calculated Property
Δvap 59.70 kJ/mol Joback Calculated Property
logPoct/wat 2.62 Crippen Calculated Property
Pc 2191.78 kPa Joback Calculated Property
Tboil 632.19 K Joback Calculated Property
Tc 835.04 K Joback Calculated Property
Tfus 382.12 K Joback Calculated Property
Vc 0.70 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 468.92 J/mol×K 632.19 Joback Calculated Property
η 0.00 Pa×s 632.19 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Methyl zingerone. 1-(3,4-Dimethoxyphenyl)hexan-3-one. 1-(3,4-Dimethoxyphenyl)heptan-3-one. 1-(3,4-Dimethoxyphenyl)decan-3-one. Zingerone. 2-Butanone, 4-(4-hydroxy-3-methoxyphenyl)-. 3-Decanone, 1-(4-hydroxy-3-methoxyphenyl)-. 1-(4-Hydroxy-3-methoxyphenyl)dodecan-3-one. 1-(4-Hydroxy-3-methoxyphenyl)tetradecan-3-one. 3,5-Heptanedione, 1,7-bis(4-hydroxy-3-methoxyphenyl)-. 1-(4-Hydroxy-3-methoxyphenyl)dodecane-3,5-dione. 1-(4-Hydroxy-3-methoxyphenyl)hexadecane-3,5-dione. (E)-1-(3,4-Dimethoxyphenyl)dec-4-en-3-one. 4-(3,4-Methylenedioxyphenyl)-2-butanone. Propanal, 3-(4-hydroxy-3-methoxyphenyl).

Find more compounds similar to 1-(3,4-Dimethoxyphenyl)pentan-3-one.

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