Chemical Properties of «beta»-Alanine, N-(3-methoxybenzoyl)-, isobutyl ester

«beta»-Alanine, N-(3-methoxybenzoyl)-, isobutyl ester

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InChI
InChI=1S/C15H21NO4/c1-11(2)10-20-14(17)7-8-16-15(18)12-5-4-6-13(9-12)19-3/h4-6,9,11H,7-8,10H2,1-3H3,(H,16,18)
InChI Key
MIGNQEYWFONBNO-UHFFFAOYSA-N
Formula
C15H21NO4
SMILES
COc1cccc(C(=O)NCCC(=O)OCC(C)C)c1
Molecular Weight1
279.33
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Physical Properties

Property Value Unit Source
Δf -202.69 kJ/mol Joback Calculated Property
Δfgas -569.28 kJ/mol Joback Calculated Property
Δfus 35.41 kJ/mol Joback Calculated Property
Δvap 76.28 kJ/mol Joback Calculated Property
log10WS -3.07 Crippen Calculated Property
logPoct/wat 2.014 Crippen Calculated Property
McVol 223.310 ml/mol McGowan Calculated Property
Pc 2012.70 kPa Joback Calculated Property
Inp [2293.00; 2293.00]   Show Hide
Inp 2293.00 NIST
Inp 2293.00 NIST
Tboil 776.57 K Joback Calculated Property
Tc 984.18 K Joback Calculated Property
Tfus 479.73 K Joback Calculated Property
Vc 0.845 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [649.30; 720.14] J/mol×K [776.57; 984.18] Show Hide
Cp,gas 649.30 J/mol×K 776.57 Joback Calculated Property
Cp,gas 663.62 J/mol×K 811.17 Joback Calculated Property
Cp,gas 676.92 J/mol×K 845.77 Joback Calculated Property
Cp,gas 689.21 J/mol×K 880.38 Joback Calculated Property
Cp,gas 700.50 J/mol×K 914.98 Joback Calculated Property
Cp,gas 710.81 J/mol×K 949.58 Joback Calculated Property
Cp,gas 720.14 J/mol×K 984.18 Joback Calculated Property

Similar Compounds

«beta»-Alanine, N-(3-methoxybenzoyl)-, propyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, butyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, ethyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, pentyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, hexyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, decyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, undecyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, dodecyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, octyl ester. «beta»-Alanine, N-(3-methoxybenzoyl)-, isohexyl ester. «beta»-Alanine, N-(4-methoxybenzoyl)-, propyl ester. «beta»-Alanine, N-(4-methoxybenzoyl)-, butyl ester. «beta»-Alanine, N-(4-methoxybenzoyl)-, ethyl ester. «beta»-Alanine, N-(4-methoxybenzoyl)-, hexyl ester. «beta»-Alanine, N-(4-methoxybenzoyl)-, pentyl ester.

Find more compounds similar to «beta»-Alanine, N-(3-methoxybenzoyl)-, isobutyl ester.

Sources

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