Chemical Properties of 2,5-Cyclohexadiene-1,4-dione, 2-phenyl- (CAS 363-03-1)

2,5-Cyclohexadiene-1,4-dione, 2-phenyl-

InChI
InChI=1S/C12H8O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8H
InChI Key
RLQZIECDMISZHS-UHFFFAOYSA-N
Formula
C12H8O2
SMILES
O=C1C=CC(=O)C(c2ccccc2)=C1
Molecular Weight1
184.19
CAS
363-03-1
Other Names
  • p-Benzoquinone, 2-phenyl-
  • Phenyl-p-benzoquinone
  • Phenyl-1,4-benzoquinone
  • Phenylquinone
  • 2-Phenyl-p-benzoquinone
  • 2-Phenyl-1,4-benzoquinone
  • 2-Phenylbenzoquinone
  • Phenylbenzoquinone
  • p-Benzoquinone, phenyl-
  • 2-Phenylquinone
  • NSC 2806
  • 2-Phenylbenzo-1,4-quinone
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Physical Properties

Property Value Unit Source
EA 2.04 ± 0.06 eV NIST
ΔfH°gas -9.46 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 12.72 kJ/mol Joback Calculated Property
IE 8.87 eV Relay (1.0) Calculated Property
logPoct/wat 1.778 Crippen Calculated Property
McVol 139.860 ml/mol McGowan Calculated Property
Tfus 374.62 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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 [348.41; 421.70] J/mol×K [664.00; 939.29] Show Hide
Cp,gas 348.41 J/mol×K 664.00 Joback Calculated Property
Cp,gas 364.06 J/mol×K 709.88 Joback Calculated Property
Cp,gas 378.38 J/mol×K 755.76 Joback Calculated Property
Cp,gas 391.32 J/mol×K 801.65 Joback Calculated Property
Cp,gas 402.88 J/mol×K 847.53 Joback Calculated Property
Cp,gas 413.02 J/mol×K 893.41 Joback Calculated Property
Cp,gas 421.70 J/mol×K 939.29 Joback Calculated Property

Similar Compounds

P-quinone, p-ethoxyphenyl. 2,5-Cyclohexadiene-1,4-dione, 2,5-bis(4-methoxyphenyl)-. 5,8-Dihydro-2-phenyl-5,8-ethano-1,4-naphthoquinone. 2-Cyclohexen-1-one, 3-phenyl-. 5,8-Dihydro-2-phenyl-5,8-methano-1,4-naphthoquinone. 2(1H)-Naphthalenone, 4-methyl. 2,4A-Dihydro-fluorene. 1,4-diphenyl-2-penten-2-one. 4,5-diphenyl-1,3-hexadiene. Licarin B. 1,2,3,10a-Tetrahydrophenanthrene. 1,2-Naphthalenedione, 1-(phenylhydrazone). 2,3-diphenyl-3-hexene. 1,2-Naphthalenedione, 1-[(4-acetylphenyl)hydrazone]. 4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2-methoxy-phenol, TES.

Find more compounds similar to 2,5-Cyclohexadiene-1,4-dione, 2-phenyl-.

Sources

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