Chemical Properties of 1-(4-Carbomethoxyphenyl)-1,2-butanedione

1-(4-Carbomethoxyphenyl)-1,2-butanedione

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InChI
InChI=1S/C12H12O4/c1-3-10(13)11(14)8-4-6-9(7-5-8)12(15)16-2/h4-7H,3H2,1-2H3
InChI Key
GIGJHMZMJPJVOR-UHFFFAOYSA-N
Formula
C12H12O4
SMILES
CCC(=O)C(=O)c1ccc(C(=O)OC)cc1
Molecular Weight1
220.22
Other Names
  • 4 -methyl-«alpha»-pyrrolidinobutyrophenone-M (carboxy-desamino-oxo-) methyl
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Physical Properties

Property Value Unit Source
Δf -338.82 kJ/mol Joback Calculated Property
Δfgas -535.91 kJ/mol Joback Calculated Property
Δfus 26.47 kJ/mol Joback Calculated Property
Δvap 67.89 kJ/mol Joback Calculated Property
log10WS -2.49 Crippen Calculated Property
logPoct/wat 1.635 Crippen Calculated Property
McVol 166.760 ml/mol McGowan Calculated Property
Pc 2823.32 kPa Joback Calculated Property
Inp [1650.00; 1650.00]   Show Hide
Inp 1650.00 NIST
Inp 1650.00 NIST
Tboil 689.65 K Joback Calculated Property
Tc 910.24 K Joback Calculated Property
Tfus 435.96 K Joback Calculated Property
Vc 0.635 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [425.69; 486.07] J/mol×K [689.65; 910.24] Show Hide
Cp,gas 425.69 J/mol×K 689.65 Joback Calculated Property
Cp,gas 437.84 J/mol×K 726.41 Joback Calculated Property
Cp,gas 449.14 J/mol×K 763.18 Joback Calculated Property
Cp,gas 459.59 J/mol×K 799.94 Joback Calculated Property
Cp,gas 469.22 J/mol×K 836.71 Joback Calculated Property
Cp,gas 478.04 J/mol×K 873.47 Joback Calculated Property
Cp,gas 486.07 J/mol×K 910.24 Joback Calculated Property
η [0.0001928; 0.0013238] Pa×s [435.96; 689.65] Show Hide
η 0.0013238 Pa×s 435.96 Joback Calculated Property
η 0.0008332 Pa×s 478.24 Joback Calculated Property
η 0.0005654 Pa×s 520.52 Joback Calculated Property
η 0.0004066 Pa×s 562.81 Joback Calculated Property
η 0.0003063 Pa×s 605.09 Joback Calculated Property
η 0.0002394 Pa×s 647.37 Joback Calculated Property
η 0.0001928 Pa×s 689.65 Joback Calculated Property

Similar Compounds

4-(2-Oxo-propionyl)-benzoic acid ethyl ester. Benzoic acid, 4-butyl-, methyl ester. 4'-Methylbutyrophenone. Methyl ar-curcumen-15-oate. 4-[(2-Pyrrolidin-1-yl)-1-butanoyl]benzoic acid, methyl ester. 4-Butylbenzoic acid, pent-2-en-4-ynyl ester. 1-(4-Aminophenyl)-2-(4-butyrylphenyl)ethane. Butyrovanillone. 1,2-Bis(4-butyrylphenyl)ethane. 4-Butylbenzoic acid, 3-methylbut-2-enyl ester. Benzoic acid, 4-acetyl-, methyl ester. 4-Isobutylbenzoic acid, methyl. 1-(4-Benzylphenyl)-1-butanone. 4'-Methoxybutyrophenone. 1-Pentanone, 1-(4-methylphenyl)-.

Find more compounds similar to 1-(4-Carbomethoxyphenyl)-1,2-butanedione.

Sources

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