Chemical Properties of 2-Isopropylidenebutanedioic acid (CAS 584-27-0)

2-Isopropylidenebutanedioic acid

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InChI
InChI=1S/C7H10O4/c1-4(2)5(7(10)11)3-6(8)9/h3H2,1-2H3,(H,8,9)(H,10,11)
InChI Key
GYXGAEAOIFNGAE-UHFFFAOYSA-N
Formula
C7H10O4
SMILES
CC(C)=C(CC(=O)O)C(=O)O
Molecular Weight1
158.15
CAS
584-27-0
Other Names
  • Isopropylidene-succinic acid
Sources

Physical Properties

Property Value Unit Source
Δf -460.30 kJ/mol Joback Calculated Property
Δfgas -619.79 kJ/mol Joback Calculated Property
Δfus 22.84 kJ/mol Joback Calculated Property
Δvap 78.14 kJ/mol Joback Calculated Property
logPoct/wat 0.88 Crippen Calculated Property
Pc 4339.67 kPa Joback Calculated Property
Tboil 655.58 K Joback Calculated Property
Tc 838.83 K Joback Calculated Property
Tfus 357.15 K Joback Calculated Property
Vc 0.46 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 301.22 J/mol×K 655.58 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>C=O (nonring) 2
-OH (alcohol) 2
=C< 2
-CH2- 1
-CH3 2

Similar Compounds

Dimethyl isopropylidene succinate. (E)-1-Propene-1,2,3-tricarboxylic acid. Methylaconitic acid, trimethyl ester. Butanedioic acid, methylene-. 1-Propene-1,2,3-tricarboxylic acid, trimethyl ester. Trimethyl (1z)-1-propene-1,2,3-tricarboxylate. 3-Methyl-delta2-penten-1,5-dioic acid. 4-Methyl itaconate. 1,2,3-Propenetricarboxylic acid, triethyl ester. Triethyl (1z)-1-propene-1,2,3-tricarboxylate. 1,2,3-Propenetricarboxylic acid, tributyl ester. Butanedioic acid, methylene-, dimethyl ester. dimethyl 3-methylpent-2-enedioate. 3-Methyl-pent-2-enedioic acid dimethyl ester, Z. 3-Methylglutakonic acid dimethyl ester.

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