Chemical Properties of Secobarbital, 1,3-dibutyl

Secobarbital, 1,3-dibutyl

InChI
InChI=1S/C21H36N2O3/c1-6-10-13-17(5)21(14-9-4)18(24)22(15-11-7-2)20(26)23(19(21)25)16-12-8-3/h9,17H,4,6-8,10-16H2,1-3,5H3
InChI Key
FMRLVZYGTGAVCZ-UHFFFAOYSA-N
Formula
C21H36N2O3
SMILES
C=CCC1(C(C)CCCC)C(=O)N(CCCC)C(=O)N(CCCC)C1=O
Molecular Weight1
364.52
Other Names
  • Secobarbital perbutylated
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Physical Properties

Property Value Unit Source
log10WS -4.52 Relay (1.0) Calculated Property
logPoct/wat 4.766 Crippen Calculated Property
McVol 316.260 ml/mol McGowan Calculated Property
Inp [2052.00; 2060.00]   Show Hide
Inp 2052.00 NIST
Inp 2056.00 NIST
Inp 2059.00 NIST
Inp 2060.00 NIST
Tfus 302.05 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Similar Compounds

2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-diethyl-5-(1-methylbutyl)-5-(2-propenyl)-. Allobarbital perbutylated. Butallylonal perbutylated. Amobarbital perbutylated. 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-5-(1-methylbutyl)-5-(2-propenyl)-. Heptabarbital, 1,3-dibutyl. Pentobarbital ethylated. Butethal perbutylated. Butallylonal perethylated. Hexobarbital perbutylated. Cineroctine. homo-6-epipodopetaline. 13-Tigloyloxy-17-oxolupanine. 1-N-butyl-phenobarbital. Amobarbital perethylated.

Find more compounds similar to Secobarbital, 1,3-dibutyl.

Sources

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