Chemical Properties of Sarcosine, n-(4-fluorobenzoyl)-, ethyl ester

Sarcosine, n-(4-fluorobenzoyl)-, ethyl ester

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InChI
InChI=1S/C12H14FNO3/c1-3-17-11(15)8-14(2)12(16)9-4-6-10(13)7-5-9/h4-7H,3,8H2,1-2H3
InChI Key
FZKUCXBKPCLOMN-UHFFFAOYSA-N
Formula
C12H14FNO3
SMILES
CCOC(=O)CN(C)C(=O)c1ccc(F)cc1
Molecular Weight1
239.24
Sources

Physical Properties

Property Value Unit Source
Δf -293.93 kJ/mol Joback Calculated Property
Δfgas -551.91 kJ/mol Joback Calculated Property
Δfus 30.98 kJ/mol Joback Calculated Property
Δvap 62.37 kJ/mol Joback Calculated Property
logPoct/wat 1.46 Crippen Calculated Property
Pc 2520.12 kPa Joback Calculated Property
Tboil 647.49 K Joback Calculated Property
Tc 849.83 K Joback Calculated Property
Tfus 419.09 K Joback Calculated Property
Vc 0.67 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 456.92 J/mol×K 647.49 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-F 1
=CH- (ring) 4
>N- 1
=C< (ring) 2
-CH2- 2
-CH3 2
>C=O (nonring) 2

Similar Compounds

Sarcosine, N-(4-fluorobenzoyl)-, propyl ester. Sarcosine, n-(4-fluorobenzoyl)-, butyl ester. Sarcosine, n-(4-fluorobenzoyl)-, pentyl ester. Sarcosine, n-(4-fluorobenzoyl)-, heptyl ester. Sarcosine, N-(4-fluorobenzoyl)-, dodecyl ester. Sarcosine, n-(4-fluorobenzoyl)-, hexadecyl ester. Sarcosine, n-(4-fluorobenzoyl)-, nonyl ester. Sarcosine, n-(4-fluorobenzoyl)-, tetradecyl ester. Sarcosine, n-(4-fluorobenzoyl)-, isohexyl ester. Sarcosine, n-(3-fluorobenzoyl)-, ethyl ester. Hippuric acid di-methyl derivative. Sarcosine, n-(4-methylbenzoyl)-, ethyl ester. Sarcosine, n-(3-fluorobenzoyl)-, propyl ester. 4-Fluorobenzoic acid, morpholide. Sarcosine, n-(4-chlorobenzoyl)-, ethyl ester.

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