ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
Bezeichnung:ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
CAS-Nr161798-03-4
Englisch Name:ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
CBNumberCB11474517
SummenformelC18H21NO4S
Molgewicht347.43
MOL-Datei161798-03-4.mol
ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE physikalisch-chemischer Eigenschaften
Schmelzpunkt | 158-160°C |
Siedepunkt | 495.9±55.0 °C(Predicted) |
Dichte | 1.183 |
storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
Löslichkeit | Chloroform (Slightly), Methanol (Slightly, Sonicated) |
Aggregatzustand | Solid |
pka | 1.39±0.10(Predicted) |
Farbe | Pale Yellow |
InChI | InChI=1S/C18H21NO4S/c1-5-22-18(21)16-12(4)19-17(24-16)13-6-7-15(14(8-13)9-20)23-10-11(2)3/h6-9,11H,5,10H2,1-4H3 |
InChIKey | AIQMFFCWDAIGNV-UHFFFAOYSA-N |
SMILES | S1C(C(OCC)=O)=C(C)N=C1C1=CC=C(OCC(C)C)C(C=O)=C1 |
CAS Datenbank | 161798-03-4(CAS DataBase Reference) |