Chemical Properties of 2,5-Piperazinedione, 3-benzyl-6-isopropyl- (CAS 14474-71-6)

2,5-Piperazinedione, 3-benzyl-6-isopropyl-

InChI
InChI=1S/C14H18N2O2/c1-9(2)12-14(18)15-11(13(17)16-12)8-10-6-4-3-5-7-10/h3-7,9,11-12H,8H2,1-2H3,(H,15,18)(H,16,17)
InChI Key
OQQPOHUVAQPSHJ-UHFFFAOYSA-N
Formula
C14H18N2O2
SMILES
CC(C)C1NC(=O)C(Cc2ccccc2)NC1=O
Molecular Weight1
246.30
CAS
14474-71-6
Other Names
  • 3-Benzyl-6-isopropyl-2,5-piperazinedione
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Physical Properties

Property Value Unit Source
ω 0.5791 Relay (1.0) Calculated Property
ΔcH°solid -7689.00 ± 4.00 kJ/mol NIST
ΔfG° 123.95 kJ/mol Joback Calculated Property
ΔfH°gas -288.79 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 33.64 kJ/mol Joback Calculated Property
ΔvapH° 110.45 kJ/mol Relay (1.0) Calculated Property
IE 8.53 eV Relay (1.0) Calculated Property
log10WS -2.65 Relay (1.0) Calculated Property
logPoct/wat 0.868 Crippen Calculated Property
McVol 196.600 ml/mol McGowan Calculated Property
Pc 2681.86 kPa Joback Calculated Property
Tboil 590.53 K Relay (1.0) Calculated Property
Tc 890.84 K Relay (1.0) Calculated Property
Tfus 418.79 K Relay (1.0) Calculated Property
Vc 0.688 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [605.92; 686.97] J/mol×K [793.58; 1056.68] Show Hide
Cp,gas 605.92 J/mol×K 793.58 Joback Calculated Property
Cp,gas 624.60 J/mol×K 837.43 Joback Calculated Property
Cp,gas 641.30 J/mol×K 881.28 Joback Calculated Property
Cp,gas 655.95 J/mol×K 925.13 Joback Calculated Property
Cp,gas 668.49 J/mol×K 968.98 Joback Calculated Property
Cp,gas 678.85 J/mol×K 1012.83 Joback Calculated Property
Cp,gas 686.97 J/mol×K 1056.68 Joback Calculated Property

Similar Compounds

Trimethylsilyl (5-benzyl-3,6-dioxopiperazin-2-yl)acetate. N-Valylphenylalanine. Pyrrolo[1,2-a]pyrazine-1,4-dione, hexahydro-3-(phenylmethyl)-. L-Phe-L-Pro lactam. 2,5-Piperazinedione, 3-(phenylmethyl)-. 2,5-Piperazinedione, 3-methyl-6-(phenylmethyl)-. 2,5-Piperazinedione, 3,6-bis(phenylmethyl)-. Colchicine. Colchicine, (+)-. Colchicine. Quinapril desethyl - H2O Me (Quinaprilate - H2O Me). Tyr-Ala, N,O-bis(trimethylsilyl)-, trimethylsilyl ester. 3-((4-Hydroxyphenyl)-methyl)-2,5-piperazinedione. inosine-5'-monophosphate, TMS. Quinine, trimethylsilyl ether.

Find more compounds similar to 2,5-Piperazinedione, 3-benzyl-6-isopropyl-.

Sources

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