Chemical Properties of «beta»-Alanine, N-(2-bromobenzoyl)-, butyl ester

«beta»-Alanine, N-(2-bromobenzoyl)-, butyl ester

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InChI
InChI=1S/C14H18BrNO3/c1-2-3-10-19-13(17)8-9-16-14(18)11-6-4-5-7-12(11)15/h4-7H,2-3,8-10H2,1H3,(H,16,18)
InChI Key
YCNWIVIRWNVMSN-UHFFFAOYSA-N
Formula
C14H18BrNO3
SMILES
CCCCOC(=O)CCNC(=O)c1ccccc1Br
Molecular Weight1
328.20
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Physical Properties

Property Value Unit Source
Δf -89.35 kJ/mol Joback Calculated Property
Δfgas -384.81 kJ/mol Joback Calculated Property
Δfus 40.44 kJ/mol Joback Calculated Property
Δvap 78.47 kJ/mol Joback Calculated Property
log10WS -4.35 Crippen Calculated Property
logPoct/wat 2.912 Crippen Calculated Property
McVol 220.850 ml/mol McGowan Calculated Property
Pc 2367.97 kPa Joback Calculated Property
Inp [2340.00; 2340.00]   Show Hide
Inp 2340.00 NIST
Inp 2340.00 NIST
Tboil 797.87 K Joback Calculated Property
Tc 1015.73 K Joback Calculated Property
Tfus 521.03 K Joback Calculated Property
Vc 0.839 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [603.80; 666.03] J/mol×K [797.87; 1015.73] Show Hide
Cp,gas 603.80 J/mol×K 797.87 Joback Calculated Property
Cp,gas 616.38 J/mol×K 834.18 Joback Calculated Property
Cp,gas 628.03 J/mol×K 870.49 Joback Calculated Property
Cp,gas 638.78 J/mol×K 906.80 Joback Calculated Property
Cp,gas 648.68 J/mol×K 943.11 Joback Calculated Property
Cp,gas 657.75 J/mol×K 979.42 Joback Calculated Property
Cp,gas 666.03 J/mol×K 1015.73 Joback Calculated Property

Similar Compounds

«beta»-Alanine, N-(2-bromobenzoyl)-, pentyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, hexyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, dodecyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, heptyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, decyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, undecyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, octyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, nonyl ester. «beta»-Alanine, N-(3-bromobenzoyl)-, butyl ester. «beta»-Alanine, N-(2-bromobenzoyl)-, ethyl ester. «beta»-Alanine, N-(3-bromobenzoyl)-, pentyl ester. «beta»-Alanine, N-(3-bromobenzoyl)-, hexyl ester. «beta»-Alanine, N-(3-bromobenzoyl)-, octyl ester. «beta»-Alanine, N-(3-bromobenzoyl)-, dodecyl ester. «beta»-Alanine, N-(3-bromobenzoyl)-, nonyl ester.

Find more compounds similar to «beta»-Alanine, N-(2-bromobenzoyl)-, butyl ester.

Sources

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