Chemical Properties of 5,8-Dihydro-2-phenyl-5,8-methano-1,4-naphthoquinone (CAS 93327-67-4)

5,8-Dihydro-2-phenyl-5,8-methano-1,4-naphthoquinone

InChI
InChI=1S/C17H12O2/c18-14-9-13(10-4-2-1-3-5-10)17(19)16-12-7-6-11(8-12)15(14)16/h1-7,9,11-12H,8H2
InChI Key
BKBUDOUPSBILIX-UHFFFAOYSA-N
Formula
C17H12O2
SMILES
O=C1C=C(c2ccccc2)C(=O)C2=C1C1C=CC2C1
Molecular Weight1
248.28
CAS
93327-67-4
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Physical Properties

Property Value Unit Source
ω 0.4573 Relay (1.0) Calculated Property
ΔfG° 186.24 kJ/mol Joback Calculated Property
ΔfH°gas 144.55 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 24.48 kJ/mol Joback Calculated Property
ΔvapH° 96.41 kJ/mol Relay (1.0) Calculated Property
IE 8.50 eV Relay (1.0) Calculated Property
log10WS -3.78 Relay (1.0) Calculated Property
logPoct/wat 2.724 Crippen Calculated Property
McVol 184.290 ml/mol McGowan Calculated Property
Pc 2732.56 kPa Joback Calculated Property
Tboil 630.72 K Relay (1.0) Calculated Property
Tc 933.72 K Relay (1.0) Calculated Property
Tfus 419.61 K Relay (1.0) Calculated Property
Vc 0.657 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [547.63; 625.13] J/mol×K [796.53; 1069.58] Show Hide
Cp,gas 547.63 J/mol×K 796.53 Joback Calculated Property
Cp,gas 563.66 J/mol×K 842.04 Joback Calculated Property
Cp,gas 578.29 J/mol×K 887.55 Joback Calculated Property
Cp,gas 591.65 J/mol×K 933.05 Joback Calculated Property
Cp,gas 603.83 J/mol×K 978.56 Joback Calculated Property
Cp,gas 614.96 J/mol×K 1024.07 Joback Calculated Property
Cp,gas 625.13 J/mol×K 1069.58 Joback Calculated Property

Similar Compounds

5,8-Dihydro-2-phenyl-5,8-ethano-1,4-naphthoquinone. Estra-1,3,5(10)-trien-17-one, 1-methyl-3,6,7-tris[(trifluoroacetyl)oxy]-, (6«alpha»,7«alpha»)-. ethyl eburnamenine-14-carboxylate. norbormide. SCHEMBL9488362. Methysergide. Heptafluorobutyryl-codeine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine.

Find more compounds similar to 5,8-Dihydro-2-phenyl-5,8-methano-1,4-naphthoquinone.

Sources

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