Chemical Properties of 3-Carbethoxy-2,5-piperazinedione (CAS 86750-34-7)

3-Carbethoxy-2,5-piperazinedione

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InChI
InChI=1S/C7H10N2O4/c1-2-13-7(12)5-6(11)8-3-4(10)9-5/h5H,2-3H2,1H3,(H,8,11)(H,9,10)
InChI Key
JGDBWGPIUGDQTO-UHFFFAOYSA-N
Formula
C7H10N2O4
SMILES
CCOC(=O)C1NC(=O)CNC1=O
Molecular Weight1
186.17
CAS
86750-34-7
Sources

Physical Properties

Property Value Unit Source
Δf -271.17 kJ/mol Joback Calculated Property
Δfgas -578.07 kJ/mol Joback Calculated Property
Δfus 26.71 kJ/mol Joback Calculated Property
Δvap 62.77 kJ/mol Joback Calculated Property
logPoct/wat -1.84 Crippen Calculated Property
Pc 4333.96 kPa Joback Calculated Property
Tboil 688.14 K Joback Calculated Property
Tc 938.95 K Joback Calculated Property
Tfus 594.69 K Joback Calculated Property
Vc 0.47 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 355.14 J/mol×K 688.14 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 1
>NH (ring) 2
-CH2- 1
>C=O (nonring) 1
>CH- (ring) 1
-CH2- (ring) 1
>C=O (ring) 2

Similar Compounds

hexa-L-alanine. penta-L-alanine. DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N''-(byt-3-yn-1-yloxycarbonyl)-, byt-3-yn-1-yl ester. Threonine-Serine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. DL-Alanyl-DL-alanyl-DL-alanine, N,N',N''-trimethyl-N'''-hexyloxycarbonyl-, hexyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, hexyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(byt-4-en-1-yloxycarbonyl)-, tetradecyl ester. DL-Alanyl-DL-alanine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, heptyl ester. Propanedioic acid, (acetylamino)-, diethyl ester. D-alanine, n-(5-chlorovaleryl)-, butyl ester. D-alanine, n-(5-chlorovaleryl)-, pentyl ester. D-alanine, n-(5-chlorovaleryl)-, hexyl ester. D-alanine, n-(5-chlorovaleryl)-, heptyl ester. L-serine, n,o-bis(caproyl)-, methyl ester. D-alanine, n-(5-chlorovaleryl)-, octyl ester.

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