Chemical Properties of 3-Phenyl-2-piperazinene (CAS 5368-28-5)

3-Phenyl-2-piperazinene

InChI
InChI=1S/C10H12N2O/c13-10-9(11-6-7-12-10)8-4-2-1-3-5-8/h1-5,9,11H,6-7H2,(H,12,13)
InChI Key
WKFFHKBGGZHQAX-UHFFFAOYSA-N
Formula
C10H12N2O
SMILES
O=C1NCCNC1c1ccccc1
Molecular Weight1
176.22
CAS
5368-28-5
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Physical Properties

Property Value Unit Source
ΔfusH° 26.22 kJ/mol Joback Calculated Property
logPoct/wat 0.447 Crippen Calculated Property
McVol 138.670 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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 [358.65; 446.49] J/mol×K [639.35; 912.32] Show Hide
Cp,gas 358.65 J/mol×K 639.35 Joback Calculated Property
Cp,gas 376.89 J/mol×K 684.84 Joback Calculated Property
Cp,gas 393.71 J/mol×K 730.34 Joback Calculated Property
Cp,gas 409.10 J/mol×K 775.83 Joback Calculated Property
Cp,gas 423.04 J/mol×K 821.33 Joback Calculated Property
Cp,gas 435.51 J/mol×K 866.82 Joback Calculated Property
Cp,gas 446.49 J/mol×K 912.32 Joback Calculated Property

Similar Compounds

Tryptophan-leucine-methionine,N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. 6-[D-(2-amino-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid. 7-[(2-hydroxy-2-phenylacetyl)amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid. Oxycodone, trimethylsilyl ether. Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5«alpha»)-. Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Butorphanol di-TMS derivative. Nalbuphine, O,O,O-tris(trimethylsilyl) deriv.. Noscapine. Cialis. 1-Alpha-2-methyl-8-methoxy-6,7-methylenedioxy-1-(6,7-dimethoxy-3-phthalidyl)-1,2,3,4-tetrahydroisoquinoline. Oxycodone. Oxycodone tms derivative. Oxymorphone, bis(trimethylsilyl) ether. cis-1,2-Tetralinediol, ferrocenylboronate.

Find more compounds similar to 3-Phenyl-2-piperazinene.

Sources

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