Chemical Properties of Sarcosine, n-hexanoyl-, butyl ester

Sarcosine, n-hexanoyl-, butyl ester

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InChI
InChI=1S/C13H25NO3/c1-4-6-8-9-12(15)14(3)11-13(16)17-10-7-5-2/h4-11H2,1-3H3
InChI Key
MJGCSNIONZRIJI-UHFFFAOYSA-N
Formula
C13H25NO3
SMILES
CCCCCC(=O)N(C)CC(=O)OCCCC
Molecular Weight1
243.34
Sources

Physical Properties

Property Value Unit Source
Δf -193.48 kJ/mol Joback Calculated Property
Δfgas -601.50 kJ/mol Joback Calculated Property
Δfus 36.83 kJ/mol Joback Calculated Property
Δvap 62.48 kJ/mol Joback Calculated Property
logPoct/wat 2.37 Crippen Calculated Property
Pc 1796.98 kPa Joback Calculated Property
Tboil 639.44 K Joback Calculated Property
Tc 814.93 K Joback Calculated Property
Tfus 390.83 K Joback Calculated Property
Vc 0.81 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 579.23 J/mol×K 639.44 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH2- 8
-CH3 3
>N- 1
>C=O (nonring) 2

Similar Compounds

Sarcosine, N-valeryl-, butyl ester. Sarcosine, n-hexanoyl-, propyl ester. Sarcosine, n-hexanoyl-, hexadecyl ester. Sarcosine, n-hexanoyl-, tetradecyl ester. Sarcosine, n-hexanoyl-, heptadecyl ester. Sarcosine, n-hexanoyl-, pentadecyl ester. Sarcosine, n-hexanoyl-, octadecyl ester. Sarcosine, n-hexanoyl-, nonyl ester. Sarcosine, n-hexanoyl-, octyl ester. Sarcosine, n-hexanoyl-, dodecyl ester. Sarcosine, n-valeryl-, pentyl ester. Sarcosine, n-valeryl-, hexyl ester. Sarcosine, n-valeryl-, propyl ester. Sarcosine, N-valeryl-, octadecyl ester. Sarcosine, n-valeryl-, decyl ester.

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