Chemical Properties of 1-(4-Hydroxy-3-methoxyphenyl)dodecane-3,5-dione (CAS 77334-06-6)

1-(4-Hydroxy-3-methoxyphenyl)dodecane-3,5-dione

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InChI
InChI=1S/C19H28O4/c1-3-4-5-6-7-8-16(20)14-17(21)11-9-15-10-12-18(22)19(13-15)23-2/h10,12-13,22H,3-9,11,14H2,1-2H3
InChI Key
QDSRAFNZQKMHPZ-UHFFFAOYSA-N
Formula
C19H28O4
SMILES
CCCCCCCC(=O)CC(=O)CCc1ccc(O)c(OC)c1
Molecular Weight1
320.42
CAS
77334-06-6
Sources

Physical Properties

Property Value Unit Source
Δf -305.58 kJ/mol Joback Calculated Property
Δfgas -745.12 kJ/mol Joback Calculated Property
Δfus 48.79 kJ/mol Joback Calculated Property
Δvap 89.74 kJ/mol Joback Calculated Property
logPoct/wat 4.22 Crippen Calculated Property
Pc 1641.76 kPa Joback Calculated Property
Tboil 876.56 K Joback Calculated Property
Tc 1086.43 K Joback Calculated Property
Tfus 576.64 K Joback Calculated Property
Vc 0.99 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 846.98 J/mol×K 876.56 Joback Calculated Property
η 0.00 Pa×s 876.56 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 2
=CH- (ring) 3
=C< (ring) 3
-CH2- 9
>C=O (nonring) 2
-OH (phenol) 1

Similar Compounds

1-(4-Hydroxy-3-methoxyphenyl)hexadecane-3,5-dione. 3,5-Heptanedione, 1,7-bis(4-hydroxy-3-methoxyphenyl)-. 1-(4-Hydroxy-3-methoxyphenyl)dodecan-3-one. 1-(4-Hydroxy-3-methoxyphenyl)tetradecan-3-one. 3-Decanone, 1-(4-hydroxy-3-methoxyphenyl)-. 1-(3,4-Dimethoxyphenyl)decan-3-one. 1-(3,4-Dimethoxyphenyl)heptan-3-one. 1-(3,4-Dimethoxyphenyl)hexan-3-one. Gingerol. Zingerone. 2-Butanone, 4-(4-hydroxy-3-methoxyphenyl)-. 1-(3,4-Dimethoxyphenyl)pentan-3-one. Methyl zingerone. 1-(3,4-Dimethoxyphenyl)-5-methoxydecan-3-one. 1-(3,4-Dimethoxyphenyl)-5-methoxyundecan-3-one.

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