Chemical Properties of Glutaric acid, but-3-yn-2-yl 4-nitrophenyl ester

Glutaric acid, but-3-yn-2-yl 4-nitrophenyl ester

InChI
InChI=1S/C15H15NO6/c1-3-11(2)21-14(17)5-4-6-15(18)22-13-9-7-12(8-10-13)16(19)20/h1,7-11H,4-6H2,2H3
InChI Key
PUNSWYCOQZKNJW-UHFFFAOYSA-N
Formula
C15H15NO6
SMILES
C#CC(C)OC(=O)CCCC(=O)Oc1ccc([N+](=O)[O-])cc1
Molecular Weight1
305.28
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Physical Properties

Property Value Unit Source
ΔfusH° 44.64 kJ/mol Joback Calculated Property
IE 9.28 eV Relay (1.0) Calculated Property
logPoct/wat 2.235 Crippen Calculated Property
McVol 222.150 ml/mol McGowan Calculated Property
Inp [2313.00; 2313.00]   Show Hide
Inp 2313.00 NIST
Inp 2313.00 NIST
Tboil 630.79 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [642.80; 693.52] J/mol×K [868.36; 1104.97] Show Hide
Cp,gas 642.80 J/mol×K 868.36 Joback Calculated Property
Cp,gas 653.97 J/mol×K 907.80 Joback Calculated Property
Cp,gas 664.02 J/mol×K 947.23 Joback Calculated Property
Cp,gas 672.97 J/mol×K 986.67 Joback Calculated Property
Cp,gas 680.85 J/mol×K 1026.10 Joback Calculated Property
Cp,gas 687.69 J/mol×K 1065.54 Joback Calculated Property
Cp,gas 693.52 J/mol×K 1104.97 Joback Calculated Property

Similar Compounds

Glutaric acid, hex-4-yn-3-yl 4-nitrophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-nitrophenyl ester. Glutaric acid, ethyl 4-nitrophenyl ester. Glutaric acid, 4-nitrophenyl propyl ester. Glutaric acid, 3-methylbut-2-yl 4-nitrophenyl ester. Glutaric acid, butyl 4-nitrophenyl ester. Glutaric acid, 2,2-dichloroethyl 4-nitrophenyl ester. Pimelic acid, ethyl 4-nitrophenyl ester. Sebacic acid, ethyl 4-nitrophenyl ester. Glutaric acid, hept-2-yl 4-nitrophenyl ester. Glutaric acid, dec-2-yl 4-nitrophenyl ester. Glutaric acid, isobutyl 4-nitrophenyl ester. Glutaric acid, 4-nitrophenyl pentyl ester. Pimelic acid, propyl 4-nitrophenyl ester. Glutaric acid, hexyl 4-nitrophenyl ester.

Find more compounds similar to Glutaric acid, but-3-yn-2-yl 4-nitrophenyl ester.

Sources

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