Chemical Properties of N-(2-octanoylmercapto) ethyloctanamide

N-(2-octanoylmercapto) ethyloctanamide

InChI
InChI=1S/C18H35NO2S/c1-3-5-7-9-11-13-17(20)19-15-16-22-18(21)14-12-10-8-6-4-2/h3-16H2,1-2H3,(H,19,20)
InChI Key
VHRMFSXVENWLHR-UHFFFAOYSA-N
Formula
C18H35NO2S
SMILES
CCCCCCCC(=O)NCCSC(=O)CCCCCCC
Molecular Weight1
329.55
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Physical Properties

Property Value Unit Source
ΔfH°gas -666.99 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 54.80 kJ/mol Joback Calculated Property
ΔvapH° 105.66 kJ/mol Relay (1.0) Calculated Property
IE 9.22 eV Relay (1.0) Calculated Property
log10WS -4.90 Relay (1.0) Calculated Property
logPoct/wat 5.083 Crippen Calculated Property
McVol 293.950 ml/mol McGowan Calculated Property
Pc 1284.67 kPa Joback Calculated Property
Tboil 626.99 K Relay (1.0) Calculated Property
Tc 833.99 K Relay (1.0) Calculated Property
Tfus 324.31 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [916.22; 1001.35] J/mol×K [837.93; 1032.47] Show Hide
Cp,gas 916.22 J/mol×K 837.93 Joback Calculated Property
Cp,gas 932.86 J/mol×K 870.35 Joback Calculated Property
Cp,gas 948.48 J/mol×K 902.78 Joback Calculated Property
Cp,gas 963.10 J/mol×K 935.20 Joback Calculated Property
Cp,gas 976.76 J/mol×K 967.62 Joback Calculated Property
Cp,gas 989.50 J/mol×K 1000.05 Joback Calculated Property
Cp,gas 1001.35 J/mol×K 1032.47 Joback Calculated Property

Similar Compounds

l-Cysteine, N,S-bis(caproyl)-, methyl ester. L-Cysteine, N,S-bis(3-cyclopentylpropionyl)-, methyl ester. L-Cysteine, N,S-bis(5-chlorovaleryl)-, methyl ester. Octanamide, N-(2-mercaptoethyl)-. N,n'-[2,2'-dithiobis(ethyloctanamide)]. Biotin, N,N'-tert-butyldimethylsilyl-, tert-butyldimethylsilyl ester. Moexipril desethyl - H2O Me (Moexprilate - H2O Me). xanthosine, TMS. (1R,4S,5S)-4-tert-Butyldimethylsilyloxy-2-aza-8-oxabicyclo[3,2,1]octane. Benzoic acid, 4-[1-hydroxy-2-(2-oxopyrrolidino)hexyl]-, ethyl ester. Supinine, diTMS. 7-acetyl echinatine, diTMS. Quinine. Acetyl ester of echimidine, diTMS. 9,10-Dihydrophenanthrene-cis-9,10-diol, ferrocenylboronate.

Find more compounds similar to N-(2-octanoylmercapto) ethyloctanamide.

Sources

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