Chemical Properties of Dl-4-(2-benzoyloxyethyl)-2-phenyl-delta^2-thiazoline (CAS 94004-88-3)

Dl-4-(2-benzoyloxyethyl)-2-phenyl-delta^2-thiazoline

InChI
InChI=1S/C18H17NO2S/c20-18(15-9-5-2-6-10-15)21-12-11-16-13-22-17(19-16)14-7-3-1-4-8-14/h1-10,16H,11-13H2
InChI Key
FNQNEBUSCQXHGX-UHFFFAOYSA-N
Formula
C18H17NO2S
SMILES
O=C(OCCC1CSC(c2ccccc2)=N1)c1ccccc1
Molecular Weight1
311.40
CAS
94004-88-3
Other Names
  • Dl-4-(2-benzoyloxyethyl)-2-phenyl-delta
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Physical Properties

Property Value Unit Source
ω 0.6546 Relay (1.0) Calculated Property
ΔfusH° 38.39 kJ/mol Joback Calculated Property
log10WS -3.91 Relay (1.0) Calculated Property
logPoct/wat 3.796 Crippen Calculated Property
McVol 235.570 ml/mol McGowan Calculated Property
Pc 2304.74 kPa Joback Calculated Property
Tboil 665.52 K Relay (1.0) Calculated Property
Tc 953.74 K Relay (1.0) Calculated Property
Tfus 358.50 K Relay (1.0) Calculated Property
Vc 0.842 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Ionization energy 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 [702.56; 769.17] J/mol×K [843.97; 1111.02] Show Hide
Cp,gas 702.56 J/mol×K 843.97 Joback Calculated Property
Cp,gas 718.12 J/mol×K 888.48 Joback Calculated Property
Cp,gas 731.77 J/mol×K 932.99 Joback Calculated Property
Cp,gas 743.62 J/mol×K 977.49 Joback Calculated Property
Cp,gas 753.75 J/mol×K 1022.00 Joback Calculated Property
Cp,gas 762.24 J/mol×K 1066.51 Joback Calculated Property
Cp,gas 769.17 J/mol×K 1111.02 Joback Calculated Property

Similar Compounds

Dl-4-(2-hydroxyethyl)-2-phenyl-delta2-thiazoline. Tinctorine. Nalmefene, bis(trifluoroacetate). 9H-Purin-2-amine, N-(trimethylsilyl)-6-[(trimethylsilyl)oxy]-9-[2,3,5-tris-O-(trimethylsilyl)-«beta»-D-ribofuranosyl]-. Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (19«alpha»)-. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. Hypoxanthine-7-ethanol, 2,3-dihydro-3-(diphenylmethyl)-, acetate. guanosine-2'(3')-monophosphate, TMS. Cytidine, metho-oxime-TMS derivative. Zinc octaethylporphyrin chloride. Sophoramine. Cytidine, buto-oxime-TMS derivative. Adenosine, 5'-S-methyl-5'-thio-N-(trimethylsilyl)-2',3'-bis-O-(trimethylsilyl)-. guanosine, TMS. 2'-Deoxyguanosine, N-trimethylsilyl-, tris(trimethylsilyl) ether.

Find more compounds similar to Dl-4-(2-benzoyloxyethyl)-2-phenyl-delta^2-thiazoline.

Sources

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