Chemical Properties of 2,5-Dimethyl-3,4-diphenylcyclopentadienone

2,5-Dimethyl-3,4-diphenylcyclopentadienone

InChI
InChI=1S/C19H16O/c1-13-17(15-9-5-3-6-10-15)18(14(2)19(13)20)16-11-7-4-8-12-16/h3-12H,1-2H3
InChI Key
SOXYIWTUKPMWCG-UHFFFAOYSA-N
Formula
C19H16O
SMILES
CC1=C(c2ccccc2)C(c2ccccc2)=C(C)C1=O
Molecular Weight1
260.34
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Physical Properties

Property Value Unit Source
ω 0.5007 Relay (1.0) Calculated Property
ΔfG° 276.99 kJ/mol Joback Calculated Property
ΔfH°gas 207.32 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 26.31 kJ/mol Joback Calculated Property
ΔvapH° 100.15 kJ/mol Relay (1.0) Calculated Property
IE 8.09 eV Relay (1.0) Calculated Property
log10WS -4.57 Relay (1.0) Calculated Property
logPoct/wat 4.516 Crippen Calculated Property
McVol 213.160 ml/mol McGowan Calculated Property
Pc 2224.99 kPa Joback Calculated Property
Tboil 636.36 K Relay (1.0) Calculated Property
Tc 930.93 K Relay (1.0) Calculated Property
Tfus 391.73 K Relay (1.0) Calculated Property
Vc 0.757 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [262.16; 663.51] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.94300e+01
Coefficient B1.29094e+00
Coefficient C-7.17400e-04
Coefficient D1.29400e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 262.16 J/mol×K 273.00 Calculated Property
Cp,gas 333.22 J/mol×K 353.78 Calculated Property
Cp,gas 396.70 J/mol×K 434.56 Calculated Property
Cp,gas 453.02 J/mol×K 515.33 Calculated Property
Cp,gas 502.60 J/mol×K 596.11 Calculated Property
Cp,gas 545.83 J/mol×K 676.89 Calculated Property
Cp,gas 583.12 J/mol×K 757.67 Calculated Property
Cp,gas 614.90 J/mol×K 838.44 Calculated Property
Cp,gas 641.56 J/mol×K 919.22 Calculated Property
Cp,gas 663.51 J/mol×K 1000.00 Calculated Property

Similar Compounds

5,8-Dihydro-2-phenyl-5,8-methano-1,4-naphthoquinone. Tetraphenylcyclopentadienone. Delta 1(2)-alpha- naphthalenemalonic acid, 3-hydroxy-4-oxo-, diethyl ester. O-methoxybenzoyl ferrocene. 5,8-Dihydro-2-phenyl-5,8-ethano-1,4-naphthoquinone. 1,2,3,10a-Tetrahydrophenanthrene. 2,4-Dimethoxybenzoyl ferrocene. (E)-(1R,2S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl 3-(benzo[d][1,3]dioxol-5-yl)acrylate. Benzene, 1,1',1'',1''',1''''-(1,3-cyclopentadiene-1,2,3,4,5-pentayl)pentakis-. cis-13-Cinnamoyloxylupanine. trans-13-Cinnamoyloxylupanine. Nomifemsine M(HO), diacetylated, isomer # 2. 2-Carboxybenzoyl ferrocene. 3',5'-Diacetylthymidine. SCHEMBL9488362.

Find more compounds similar to 2,5-Dimethyl-3,4-diphenylcyclopentadienone.

Sources

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