Chemical Properties of 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, isobutyl ester

1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, isobutyl ester

InChI
InChI=1S/C14H24ClNO4/c1-11(2)10-20-12(17)14(6-3-4-7-14)16-13(18)19-9-5-8-15/h11H,3-10H2,1-2H3,(H,16,18)
InChI Key
HLHCUHZTRVHYFG-UHFFFAOYSA-N
Formula
C14H24ClNO4
SMILES
CC(C)COC(=O)C1(NC(=O)OCCCCl)CCCC1
Molecular Weight1
305.80
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Physical Properties

Property Value Unit Source
ΔfH°gas -928.86 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 34.16 kJ/mol Joback Calculated Property
ΔvapH° 90.94 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.853 Crippen Calculated Property
McVol 234.360 ml/mol McGowan Calculated Property
Inp [2054.00; 2054.00]   Show Hide
Inp 2054.00 NIST
Inp 2054.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [327.27; 794.14] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-5.94960e+01
Coefficient B1.73674e+00
Coefficient C-1.28080e-03
Coefficient D3.97700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 327.27 J/mol×K 273.00 Calculated Property
Cp,gas 412.23 J/mol×K 353.78 Calculated Property
Cp,gas 485.99 J/mol×K 434.56 Calculated Property
Cp,gas 549.79 J/mol×K 515.33 Calculated Property
Cp,gas 604.91 J/mol×K 596.11 Calculated Property
Cp,gas 652.59 J/mol×K 676.89 Calculated Property
Cp,gas 694.10 J/mol×K 757.67 Calculated Property
Cp,gas 730.69 J/mol×K 838.44 Calculated Property
Cp,gas 763.62 J/mol×K 919.22 Calculated Property
Cp,gas 794.14 J/mol×K 1000.00 Calculated Property

Similar Compounds

1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, propyl ester. 1-Aminocyclopentanecarboxylic acid, N-(propoxycarbonyl)-, isobutyl ester. 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, pentyl ester. 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, undecyl ester. 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, octyl ester. 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, nonyl ester. 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, heptyl ester. 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, dodecyl ester. 1-Aminocyclopentanecarboxylic acid, N-(isobutoxycarbonyl)-, pentyl ester. 1-Aminocyclopentanecarboxylic acid, N-(hexyloxycarbonyl)-, propyl ester. 1-Aminocyclopentanecarboxylic acid, N-(but-3-yn-1-yloxycarbonyl)-, propyl ester. 1-Aminocyclopentanecarboxylic acid, N-(2-chloroethoxycarbonyl)-, isobutyl ester. 1-Aminocyclopentanecarboxylic acid, N-(2,2,2-trichloroethoxycarbonyl)-, isobutyl ester. 1-Aminocyclopentanecarboxylic acid, N-(but-3-yn-1-yloxycarbonyl)-, pentyl ester. 1-Aminocyclopentanecarboxylic acid, N-(2-chloroethoxycarbonyl)-, pentyl ester.

Find more compounds similar to 1-Aminocyclopentanecarboxylic acid, 3-chloropropoxycarbonyl-, isobutyl ester.

Sources

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