Chemical Properties of 2-Ethylbutyric acid, 4-bromo-2-methoxyphenyl ester

2-Ethylbutyric acid, 4-bromo-2-methoxyphenyl ester

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InChI
InChI=1S/C13H17BrO3/c1-4-9(5-2)13(15)17-11-7-6-10(14)8-12(11)16-3/h6-9H,4-5H2,1-3H3
InChI Key
DJJDARBLXWGICA-UHFFFAOYSA-N
Formula
C13H17BrO3
SMILES
CCC(CC)C(=O)Oc1ccc(Br)cc1OC
Molecular Weight1
301.18
Sources

Physical Properties

Property Value Unit Source
Δf -175.31 kJ/mol Joback Calculated Property
Δfgas -454.03 kJ/mol Joback Calculated Property
Δfus 28.43 kJ/mol Joback Calculated Property
Δvap 65.75 kJ/mol Joback Calculated Property
logPoct/wat 3.80 Crippen Calculated Property
Pc 2358.78 kPa Joback Calculated Property
Tboil 697.91 K Joback Calculated Property
Tc 915.61 K Joback Calculated Property
Tfus 426.92 K Joback Calculated Property
Vc 0.75 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 509.91 J/mol×K 697.91 Joback Calculated Property
η 0.00 Pa×s 697.91 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Glutaric acid, di(4-bromo-2-methoxyphenyl) ester. Succinic acid, di(4-bromo-2-methoxyphenyl) ester. Diethylmalonic acid, di(4-bromo-2-methoxyphenyl) ester. Glutaric acid, 8-chlorooctyl 4-bromo-2-methoxyphenyl ester. 4-Bromoguaiacol, acetate. Glutaric acid, 2,2-dichloroethyl 4-bromo-2-methoxyphenyl ester. Glutaric acid, 2-ethylhexyl 4-bromo-2-methoxyphenyl ester. 2-Ethylbutyric acid, 2-isopropoxyphenyl ester. Glutaric acid, cyclohexylmethyl 4-bromo-2-methoxyphenyl ester. Succinic acid, 8-chlorooctyl 4-bromo-2-methoxyphenyl ester. Succinic acid, 2-ethylhexyl 4-bromo-2-methoxyphenyl ester. Succinic acid, cyclohexylmethyl 4-bromo-2-methoxyphenyl ester. Glutaric acid, 3-methylbut-2-en-1-yl 4-bromo-2-methoxyphenyl ester. Glutaric acid, but-3-yn-2-yl 4-bromo-2-methoxyphenyl ester. Glutaric acid, hept-2-yl 4-bromo-2-methoxyphenyl ester.

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