Chemical Properties of L-Methionine, N-heptafluorobutyryl-, propyl ester (CAS 88436-11-7)

L-Methionine, N-heptafluorobutyryl-, propyl ester

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InChI
InChI=1S/C12H16F7NO3S/c1-3-5-23-8(21)7(4-6-24-2)20-9(22)10(13,14)11(15,16)12(17,18)19/h7H,3-6H2,1-2H3,(H,20,22)
InChI Key
DXEDYBBAJBCCRO-UHFFFAOYSA-N
Formula
C12H16F7NO3S
SMILES
CCCOC(=O)C(CCSC)NC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
387.31
CAS
88436-11-7
Other Names
  • L-Methionine, N-heptafluorobutyryl-, propyl ester
Sources

Physical Properties

Property Value Unit Source
Δf -1547.76 kJ/mol Joback Calculated Property
Δfgas -1957.35 kJ/mol Joback Calculated Property
Δfus 36.25 kJ/mol Joback Calculated Property
Δvap 61.47 kJ/mol Joback Calculated Property
logPoct/wat 3.01 Crippen Calculated Property
Pc 1624.60 kPa Joback Calculated Property
Tboil 707.83 K Joback Calculated Property
Tc 884.98 K Joback Calculated Property
Tfus 430.54 K Joback Calculated Property
Vc 0.91 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 665.77 J/mol×K 707.83 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
>C=O (nonring) 2
-CH2- 4
-S- 1
-F 7
>C< 3
>NH 1
-CH3 2

Similar Compounds

L-methionine, n-heptafluorobutyryl-, butyl ester. L-methionine, n-heptafluorobutyryl-, ethyl ester. L-methionine, n-heptafluorobutyryl-, isobutyl ester. L-methionine, n-heptafluorobutyryl-, pentyl ester. L-methionine, n-heptafluorobutyryl-, hexyl ester. L-methionine, n-heptafluorobutyryl-, tetradecyl ester. L-methionine, n-heptafluorobutyryl-, pentadecyl ester. L-methionine, n-heptafluorobutyryl-, octadecyl ester. L-valine, n-heptafluorobutyryl-, pentyl ester. L-valine, n-heptafluorobutyryl-, isobutyl ester. L-Valine, N-heptafluorobutyryl-, heptyl ester. L-valine, n-heptafluorobutyryl-, nonyl ester. L-valine, n-heptafluorobutyryl-, heptadecyl ester. L-valine, n-heptafluorobutyryl-, octadecyl ester. L-valine, n-heptafluorobutyryl-, hexadecyl ester.

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