Chemical Properties of 3-Methoxy-cuminyl isobutyrate

3-Methoxy-cuminyl isobutyrate

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InChI
InChI=1S/C15H22O3/c1-10(2)13-7-6-12(8-14(13)17-5)9-18-15(16)11(3)4/h6-8,10-11H,9H2,1-5H3
InChI Key
JVOZDVTWETUPPI-UHFFFAOYSA-N
Formula
C15H22O3
SMILES
COc1cc(COC(=O)C(C)C)ccc1C(C)C
Molecular Weight1
250.33
Sources

Physical Properties

Property Value Unit Source
Δf -175.23 kJ/mol Joback Calculated Property
Δfgas -526.92 kJ/mol Joback Calculated Property
Δfus 24.80 kJ/mol Joback Calculated Property
Δvap 63.37 kJ/mol Joback Calculated Property
logPoct/wat 3.52 Crippen Calculated Property
Pc 1870.79 kPa Joback Calculated Property
Tboil 677.07 K Joback Calculated Property
Tc 881.74 K Joback Calculated Property
Tfus 374.66 K Joback Calculated Property
Vc 0.80 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 574.52 J/mol×K 677.07 Joback Calculated Property
η 0.00 Pa×s 677.07 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
-CH3 5
=CH- (ring) 3
=C< (ring) 3
-CH2- 1
>C=O (nonring) 1

Similar Compounds

3-Methoxy cuminyl alcohol, isobutyryl ester. 3-Methoxy cuminyl alcohol, isovaleryl ester. Thymyl formate. Benzene, 2-methoxy-4-methyl-1-(1-methylethyl)-. Benzene, 1-(1,1-dimethylethyl)-2-methoxy-4-methyl-. Glutaric acid, di(3-methoxybenzyl) ester. Glutaric acid, ethyl 3-methoxybenzyl ester. Glutaric acid, isobutyl 3-methoxybenzyl ester. Phenol, 5-methyl-2-(1-methylethyl)-, acetate. Glutaric acid, 3-methoxybenzyl propyl ester. Glutaric acid, butyl 3-methoxybenzyl ester. 2,5-Dimethoxy-4-isopropyltoluene. Glutaric acid, 3-methoxybenzyl pentyl ester. Succinic acid, di(3-methoxybenzyl) ester. Glutaric acid, hexyl 3-methoxybenzyl ester.

Find more compounds similar to 3-Methoxy-cuminyl isobutyrate.

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