Chemical Properties of Heptabarbital, 1,3-dibutyl

Heptabarbital, 1,3-dibutyl

InChI
InChI=1S/C21H34N2O3/c1-4-7-15-22-18(24)21(6-3,17-13-11-9-10-12-14-17)19(25)23(20(22)26)16-8-5-2/h13H,4-12,14-16H2,1-3H3
InChI Key
MDUSDFNVLVIWCQ-UHFFFAOYSA-N
Formula
C21H34N2O3
SMILES
CCCCN1C(=O)N(CCCC)C(=O)C(CC)(C2=CCCCCC2)C1=O
Molecular Weight1
362.51
Other Names
  • Heptabarbital perbutylated
  • Heptobarbital butylated
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Physical Properties

Property Value Unit Source
log10WS -4.75 Relay (1.0) Calculated Property
logPoct/wat 4.664 Crippen Calculated Property
McVol 305.400 ml/mol McGowan Calculated Property
Inp [2343.00; 2343.00]   Show Hide
Inp 2343.00 NIST
Inp 2343.00 NIST
Tfus 356.31 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

Hexobarbital perbutylated. 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-1-ethyl-3,5-dimethyl-. 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohepten-1-yl)-5-ethyl-1,3-dimethyl-. Barbituric acid, 5-(1-cyclohexen-1-yl)-5-ethyl-1,3-dimethyl-. Heptabarbital monomethylated. dehydropanamine-type. Thymidine, 3'-O-TFA, 5'-O-cyclotetramethylene-isopropylsilyl. Benazepril Me. Thymidine, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TMS. 1H-Indole-3-ethanol, 2-(5-ethenyl-1-azabicyclo[2.2.2]oct-2-yl)-, [1S-(1«alpha»,2«alpha»,4«alpha»,5«beta»)]-. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-TBDMS. Thymidine, 3'-O-TMS, 5'-O-cyclotetramethylene-tertbutylsilyl. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-TBDMS. Thymidine, 5'-O-cyclotetramethylene-isopropylsilyl.

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

Sources

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