Chemical Properties of Sarcosine, n-(2-trifluoromethylbenzoyl)-, butyl ester

Sarcosine, n-(2-trifluoromethylbenzoyl)-, butyl ester

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InChI
InChI=1S/C15H18F3NO3/c1-3-4-9-22-13(20)10-19(2)14(21)11-7-5-6-8-12(11)15(16,17)18/h5-8H,3-4,9-10H2,1-2H3
InChI Key
NIKXWMALAQVBGD-UHFFFAOYSA-N
Formula
C15H18F3NO3
SMILES
CCCCOC(=O)CN(C)C(=O)c1ccccc1C(F)(F)F
Molecular Weight1
317.30
Sources

Physical Properties

Property Value Unit Source
Δf -655.45 kJ/mol Joback Calculated Property
Δfgas -1014.80 kJ/mol Joback Calculated Property
Δfus 37.49 kJ/mol Joback Calculated Property
Δvap 66.12 kJ/mol Joback Calculated Property
logPoct/wat 3.12 Crippen Calculated Property
Pc 1809.23 kPa Joback Calculated Property
Tboil 711.44 K Joback Calculated Property
Tc 902.02 K Joback Calculated Property
Tfus 456.50 K Joback Calculated Property
Vc 0.86 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 632.13 J/mol×K 711.44 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 2
=CH- (ring) 4
-CH2- 4
=C< (ring) 2
>N- 1
-F 3
>C< 1
>C=O (nonring) 2

Similar Compounds

Sarcosine, n-(2-trifluoromethylbenzoyl)-, pentyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, hexyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, heptyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, decyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, isohexyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, heptadecyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, undecyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, tetradecyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, dodecyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, pentadecyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, hexadecyl ester. Sarcosine, n-(2-trifluoromethylbenzoyl)-, ethyl ester. Sarcosine, n-(2-methylbenzoyl)-, butyl ester. Sarcosine, n-(2-methylbenzoyl)-, propyl ester. Sarcosine, n-(2-methylbenzoyl)-, nonyl ester.

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