Chemical Properties of (Z) 1-(4-Methoxyphenyl)-3-phenyl-3-thioxo-1-propen-1-ol (CAS 76526-09-5)

(Z) 1-(4-Methoxyphenyl)-3-phenyl-3-thioxo-1-propen-1-ol

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InChI
InChI=1S/C16H14O2S/c1-18-14-9-7-12(8-10-14)15(17)11-16(19)13-5-3-2-4-6-13/h2-11,17H,1H3/b15-11-
InChI Key
IJXXYIYPKAEPGP-PTNGSMBKSA-N
Formula
C16H14O2S
SMILES
COc1ccc(C(O)=CC(=S)c2ccccc2)cc1
Molecular Weight1
270.35
CAS
76526-09-5
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Physical Properties

Property Value Unit Source
ΔfG° 245.94 kJ/mol Joback Calculated Property
ΔfH°gas 57.50 kJ/mol Joback Calculated Property
ΔfusH° 33.66 kJ/mol Joback Calculated Property
ΔvapH° 82.28 kJ/mol Joback Calculated Property
log10WS -4.73 Crippen Calculated Property
logPoct/wat 4.012 Crippen Calculated Property
McVol 208.270 ml/mol McGowan Calculated Property
Pc 2820.33 kPa Joback Calculated Property
Tboil 812.50 K Joback Calculated Property
Tc 1053.00 K Joback Calculated Property
Tfus 433.72 K Joback Calculated Property
Vc 0.769 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [555.89; 618.09] J/mol×K [812.50; 1053.00] Show Hide
Cp,gas 555.89 J/mol×K 812.50 Joback Calculated Property
Cp,gas 567.86 J/mol×K 852.58 Joback Calculated Property
Cp,gas 579.03 J/mol×K 892.67 Joback Calculated Property
Cp,gas 589.52 J/mol×K 932.75 Joback Calculated Property
Cp,gas 599.44 J/mol×K 972.83 Joback Calculated Property
Cp,gas 608.93 J/mol×K 1012.91 Joback Calculated Property
Cp,gas 618.09 J/mol×K 1053.00 Joback Calculated Property

Similar Compounds

(Z) 1,3-Diphenyl-3-thioxo-1-propen-1-ol. (Z) 1-(4-Bromophenyl)-3-phenyl-3-thioxo-1-propen-1-ol. 3-Flavene. PROPAFENONE-H2O, M(HO-)-H2O, AC. Amitriptyline M(Nor-HO), acetylated. Dosulepin-M (nor-HO-) 2AC. 2-Acetoxy-1-(N-acetyl-N-isopropyl)amino-3-(4-acetoxy-2-allylphenoxy)propane. Dosulepin-M (HO-) isomer-2 AC. Alprenolol, N,O-di(acetyl)-. Nadolol, N-methyl-, trimethyl ether. 2-Acetoxy-1-(N-acetyl-N-isopropyl)amino-3-[4-(2-cyclopropylmethoxyethyl)phenoxy]propane. (1S,2R)-2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-dimethoxyphenyl)propan-1-ol. 2H,5H-Pyrano[3,2-c][1]benzopyran-5-one, 3,4-dihydro-2-methoxy-2-methyl-4-phenyl-. 7-tiglyl echinatine, diTMS, dihydro. 7-angelyl echinatine, diTMS, dihydro.

Find more compounds similar to (Z) 1-(4-Methoxyphenyl)-3-phenyl-3-thioxo-1-propen-1-ol.

Sources

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