Chemical Properties of Acetic acid, [(7-oxo-7h-benz[de]anthracen-3-yl)thio]-

Acetic acid, [(7-oxo-7h-benz[de]anthracen-3-yl)thio]-

InChI
InChI=1S/C19H12O3S/c20-17(21)10-23-16-9-8-12-11-4-1-2-5-13(11)19(22)15-7-3-6-14(16)18(12)15/h1-9H,10H2,(H,20,21)
InChI Key
QQRGUQLAJOQLIW-UHFFFAOYSA-N
Formula
C19H12O3S
SMILES
O=C(O)CSc1ccc2c3c(cccc13)C(=O)c1ccccc1-2
Molecular Weight1
320.37
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Physical Properties

Property Value Unit Source
ΔfusH° 39.10 kJ/mol Joback Calculated Property
IE 7.84 eV Relay (1.0) Calculated Property
logPoct/wat 4.228 Crippen Calculated Property
McVol 226.090 ml/mol McGowan Calculated Property
Tfus 493.93 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, 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 [665.44; 724.07] J/mol×K [1011.90; 1268.12] Show Hide
Cp,gas 665.44 J/mol×K 1011.90 Joback Calculated Property
Cp,gas 675.70 J/mol×K 1054.60 Joback Calculated Property
Cp,gas 685.58 J/mol×K 1097.31 Joback Calculated Property
Cp,gas 695.22 J/mol×K 1140.01 Joback Calculated Property
Cp,gas 704.75 J/mol×K 1182.71 Joback Calculated Property
Cp,gas 714.33 J/mol×K 1225.41 Joback Calculated Property
Cp,gas 724.07 J/mol×K 1268.12 Joback Calculated Property

Similar Compounds

Benzo[rst]pentaphene-5,8-dione. 1-Methyl-6«alpha»,7«alpha»-dihydroxyestrone, TMS. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Thymidine, 3'-O-cyclotetramethylene-isopropylsilyl, 5'-O-acetyl. Cialis. Thymidine, 3'-O-cyclotetramethylene-tertbutylsilyl, 5'-O-acetyl. Adenosine, N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-, 5'-[bis(trimethylsilyl) phosphate]. Thymine, 1-alpha-l-rhamnopyranosyl-. xanthosine, TMS. 1-Methyladenine riboside, TMS. Cilostazol. N6-TMS-Adenosine, 2',3',5'-tris-O-TBDMS. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(endo),6(endo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. 1-Methyladenosine,tris(trimethylsilyl) ether. 5-methyluridine, TMS.

Find more compounds similar to Acetic acid, [(7-oxo-7h-benz[de]anthracen-3-yl)thio]-.

Sources

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