Chemical Properties of Sulfonyl-o,o'-diphenacyldibenzoate

Sulfonyl-o,o'-diphenacyldibenzoate

InChI
InChI=1S/C30H22O8S/c31-27(19-37-29(33)21-9-3-1-4-10-21)23-13-7-15-25(17-23)39(35,36)26-16-8-14-24(18-26)28(32)20-38-30(34)22-11-5-2-6-12-22/h1-18H,19-20H2
InChI Key
GVZIKXFDOKNAHI-UHFFFAOYSA-N
Formula
C30H22O8S
SMILES
O=C(COC(=O)c1ccccc1)c1cccc(S(=O)(=O)c2cccc(C(=O)COC(=O)c3ccccc3)c2)c1
Molecular Weight1
542.56
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Physical Properties

Property Value Unit Source
ω 1.1559 Relay (1.0) Calculated Property
ΔfusH° 72.16 kJ/mol Joback Calculated Property
ΔvapH° 174.97 kJ/mol Relay (1.0) Calculated Property
IE 8.94 eV Relay (1.0) Calculated Property
log10WS -6.58 Relay (1.0) Calculated Property
logPoct/wat 4.599 Crippen Calculated Property
McVol 384.630 ml/mol McGowan Calculated Property
Pc 1583.49 kPa Joback Calculated Property
Tboil 847.09 K Relay (1.0) Calculated Property
Tc 1224.77 K Relay (1.0) Calculated Property
Tfus 436.92 K Relay (1.0) Calculated Property
Vc 1.356 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation 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 [1124.04; 1179.08] J/mol×K [1274.64; 1560.52] Show Hide
Cp,gas 1179.08 J/mol×K 1274.64 Joback Calculated Property
Cp,gas 1175.18 J/mol×K 1322.29 Joback Calculated Property
Cp,gas 1169.00 J/mol×K 1369.93 Joback Calculated Property
Cp,gas 1160.66 J/mol×K 1417.58 Joback Calculated Property
Cp,gas 1150.30 J/mol×K 1465.23 Joback Calculated Property
Cp,gas 1138.05 J/mol×K 1512.87 Joback Calculated Property
Cp,gas 1124.04 J/mol×K 1560.52 Joback Calculated Property

Similar Compounds

Sulfonyl-o,p'-diphenacyldibenzoate. Sulfonyl-m,p'-dibenzoic acid, diphenacyl ester. Sulfonyl-o,m'-dibenzoic acid, diphenacyl ester. Thio-o,o'-benzoic acid, diphenacyl ester. 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. (-)-2-Aminobutan-1-ol, ferroceneboronate derivative. (2S,3S)-Butane-2,3-diol, 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Pinacol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Valine-glutamine-tryptophan-leucine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. Bufotalin. Uridine, 2'-O-TBDMS, 3'-O-acetyl, 5'-O-TBDMS. N-Desmethylmirtazapine. azadirachtin. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. Noscapine.

Find more compounds similar to Sulfonyl-o,o'-diphenacyldibenzoate.

Sources

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