Chemical Properties of 4-(3-Methyloxiranyl)-phenyl-2-methyl butyrate

4-(3-Methyloxiranyl)-phenyl-2-methyl butyrate

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InChI
InChI=1S/C14H18O3/c1-4-9(2)14(15)17-12-7-5-11(6-8-12)13-10(3)16-13/h5-10,13H,4H2,1-3H3
InChI Key
GZZHKMKHBABOEJ-UHFFFAOYSA-N
Formula
C14H18O3
SMILES
CCC(C)C(=O)Oc1ccc(C2OC2C)cc1
Molecular Weight1
234.29
Sources

Physical Properties

Property Value Unit Source
Δf -99.66 kJ/mol Joback Calculated Property
Δfgas -436.85 kJ/mol Joback Calculated Property
Δfus 32.12 kJ/mol Joback Calculated Property
Δvap 62.58 kJ/mol Joback Calculated Property
logPoct/wat 3.10 Crippen Calculated Property
Pc 2258.96 kPa Joback Calculated Property
Tboil 656.25 K Joback Calculated Property
Tc 872.63 K Joback Calculated Property
Tfus 383.91 K Joback Calculated Property
Vc 0.71 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 513.69 J/mol×K 656.25 Joback Calculated Property
η 0.00 Pa×s 656.25 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-O- (ring) 1
-CH3 3
=CH- (ring) 4
=C< (ring) 2
-CH2- 1
>C=O (nonring) 1
>CH- (ring) 2

Similar Compounds

4-(3-Methyloxiranyl)-phenyl tiglate. Epoxypseudoisoeugenyl 2-methylbutyrate. 2-Ethylbutyric acid, 4-acetylphenyl ester. (S)-1-(4-Acetoxyphenyl)propyl acetate. 1-(4-Methoxyphenyl)propane-1,2-diol. Epoxypseudoisoeugenyl tiglate I. Epoxypseudoisoeugenyl tiglate. Epoxypseudoisoeugenyl tiglate II. (S)-4-(1-Acetoxyallyl)phenyl acetate. Butanoic acid, 2-methyl-, 4-methoxy-2-(3-methyloxiranyl)phenyl ester. 2-Ethylbutyric acid, 4-cyanophenyl ester. (S)-4-(1-Hydroxyallyl)phenyl acetate. Cyclobutanecarboxylic acid, 4-cyanophenyl ester. 4-(1-Propenyl)-phenyl-2-methyl butyrate. Isochavicol 2-methylbutyrate.

Find more compounds similar to 4-(3-Methyloxiranyl)-phenyl-2-methyl butyrate.

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