Chemical Properties of Methyl 4-(3,4-methylenedioxyphenyl)butanoate

Methyl 4-(3,4-methylenedioxyphenyl)butanoate

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InChI
InChI=1S/C12H14O4/c1-14-12(13)4-2-3-9-5-6-10-11(7-9)16-8-15-10/h5-7H,2-4,8H2,1H3
InChI Key
VHUABZULWQQCDI-UHFFFAOYSA-N
Formula
C12H14O4
SMILES
COC(=O)CCCc1ccc2c(c1)OCO2
Molecular Weight1
222.24
Sources

Physical Properties

Property Value Unit Source
Δf -194.39 kJ/mol Joback Calculated Property
Δfgas -493.08 kJ/mol Joback Calculated Property
Δfus 35.91 kJ/mol Joback Calculated Property
Δvap 64.30 kJ/mol Joback Calculated Property
logPoct/wat 1.91 Crippen Calculated Property
Pc 2835.36 kPa Joback Calculated Property
Tboil 652.20 K Joback Calculated Property
Tc 870.40 K Joback Calculated Property
Tfus 423.94 K Joback Calculated Property
Vc 0.62 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 435.80 J/mol×K 652.2 Joback Calculated Property
η 0.00 Pa×s 652.2 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

2-Hexanone, 6-(3,4-methylenedioxyphenyl). 4-(3,4-Methylenedioxyphenyl)-2-butanone. 1,3-Benzodioxole, 5-propyl-. 2-Octanone, 8-(3,4-methylenedioxyphenyl). 1,3-benzodioxole-5-propionaldehyde. .BETA.(3,4-methylenedioxyphenyl)propionic acid. 4-((2S,3R)-4-(Benzo[d][1,3]dioxol-5-yl)-2,3-dimethylbutyl)-2-methoxyphenol. 5,5'-((2R,3S)-2,3-Dimethylbutane-1,4-diyl)bis(benzo[d][1,3]dioxole). 1,3-Benzodioxole-5-propanal, .alpha.-methyl-. (.+/-.)-BDB. 3,4-Methylenedioxyphenyl acetone. Tenamfetamine. Tenamfetamine. «alpha»-Methyl-3,4-(methylenedioxy)phenethylamine hydrochloride. (2R,3R)-2,3-bis(Benzo[d][1,3]dioxol-5-ylmethyl)butane-1,4-diol.

Find more compounds similar to Methyl 4-(3,4-methylenedioxyphenyl)butanoate.

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