Chemical Properties of 2,6-Diphenyl-4-thiopyrone

2,6-Diphenyl-4-thiopyrone

InChI
InChI=1S/C17H12OS/c18-15-11-16(13-7-3-1-4-8-13)19-17(12-15)14-9-5-2-6-10-14/h1-12H
InChI Key
ATWNDGSQGMSBJZ-UHFFFAOYSA-N
Formula
C17H12OS
SMILES
O=c1cc(-c2ccccc2)sc(-c2ccccc2)c1
Molecular Weight1
264.35
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Physical Properties

Property Value Unit Source
ω 0.5289 Relay (1.0) Calculated Property
ΔcH°solid -9060.00 ± 12.00 kJ/mol NIST
ΔfH°gas 187.85 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 131.57 kJ/mol Relay (1.0) Calculated Property
IE 8.17 eV Relay (1.0) Calculated Property
logPoct/wat 4.442 Crippen Calculated Property
McVol 201.330 ml/mol McGowan Calculated Property
Pc 2956.88 kPa Relay (1.0-beta) Calculated Property
Tboil 702.47 K Relay (1.0) Calculated Property
Tc 960.15 K Relay (1.0) Calculated Property
Tfus 431.35 K Relay (1.0) Calculated Property
Vc 0.720 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, 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.

Similar Compounds

Thiophene, 2,5-diphenyl-. Thiophene, 2-phenyl-. Thiophene, 2,4-diphenyl-. Benzo[b]thiophene, 2-(2-naphthalenyl)-. Thiophene, tetraphenyl-. 3-Acetyl-2-methyl-5-phenylthiophene. 2,3'-Bithiophene. 3H-1,2-Dithiole-3-thione, 5-phenyl-. Thiazolo[3,2-a]pyridinium, 3-hydroxy-2-phenyl-, hydroxide, inner salt. Thiazolo[3,2-a]pyridinium, 3,8-dihydroxy-2-phenyl-, hydroxide, inner salt. Thiazolo[3,2-a]pyridinium, 8-(acetyloxy)-3-hydroxy-2-phenyl-, hydroxide, inner salt. 2-Methyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cyclohepten-7-ol, acetate. Valsartan 2Me. 9Z,11E-Tetradecadien-1-yl acetate, adduct with 4-methyl-1,2,4-triazolin-3,5-dione. 8E,10E-Dodecadien-1-yl acetate, adduct with 4-methyl-1,2,4-triazolin-3,5-dione.

Find more compounds similar to 2,6-Diphenyl-4-thiopyrone.

Sources

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