Chemical Properties of Thiazole-5-ethanol, 4-methyl, acetate (CAS 656-53-1)

Thiazole-5-ethanol, 4-methyl, acetate

InChI
InChI=1S/C8H11NO2S/c1-6-8(12-5-9-6)3-4-11-7(2)10/h5H,3-4H2,1-2H3
InChI Key
CRTCWNPLKVVXIX-UHFFFAOYSA-N
Formula
C8H11NO2S
SMILES
CC(=O)OCCc1scnc1C
Molecular Weight1
185.24
CAS
656-53-1
Other Names
  • 2-(4-methylthiazol-5-yl)ethyl acetate
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Physical Properties

Property Value Unit Source
Δvap 73.72 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 1.557 Crippen Calculated Property
McVol 137.890 ml/mol McGowan Calculated Property
Inp 1368.00 NIST
I [2077.00; 2077.00]   Show Hide
I 2077.00 NIST
I 2077.00 NIST
Tboil 518.96 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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

5-Thiazoleethanol, 4-methyl-. 4-Methyl-5-ethylthiazole. Clomethiazole. Polythiazide. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(exo),6(endo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(exo),6(exo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Poligodial + m-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(endo),6(endo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Quinapril desethyl 3Me (Quinaprilate 3Me). Benzo[b]-7-oxa-bicyclo[2,2,2]oct-2-en-5(endo),6(exo)-dicarboxylic acid, 4-methyl-1-phenyl, dimethyl ester. Poligodial + m-Tyr (ethyl ester) adduct (R,S), acetylated, # 2. Poligodial + m-Tyr (ethyl ester) adduct (R,S). Desacetyldoronine (otonecin-jaconine). Avenaciolide, 6-[2-(3-ethoxyphenyl)ethyl]-4-demethylene. Poligodial + p-Tyr (ethyl ester) adduct (S).

Find more compounds similar to Thiazole-5-ethanol, 4-methyl, acetate.

Sources

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