Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate
Bezeichnung:Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate
CAS-Nr160844-75-7
Englisch Name:Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate
CBNumberCB22129451
SummenformelC18H20N2O3S
Molgewicht344.43
MOL-Datei160844-75-7.mol
Ethyl 2-(3-cyano-4-isobutoxyphenyl)-4-methyl-5-thiazolecarboxylate physikalisch-chemischer Eigenschaften
Schmelzpunkt | 176 °C |
Siedepunkt | 497.1±55.0 °C(Predicted) |
Dichte | 1.22 |
storage temp. | Sealed in dry,Room Temperature |
Löslichkeit | DMSO (Slightly, Heated), Methanol (Very Slightly, Heated) |
Aggregatzustand | Solid |
pka | 1.02±0.10(Predicted) |
Farbe | White to Off-White |
InChI | InChI=1S/C18H20N2O3S/c1-5-22-18(21)16-12(4)20-17(24-16)13-6-7-15(14(8-13)9-19)23-10-11(2)3/h6-8,11H,5,10H2,1-4H3 |
InChIKey | OGAZOYHQFBSRMC-UHFFFAOYSA-N |
SMILES | S1C(C(OCC)=O)=C(C)N=C1C1=CC=C(OCC(C)C)C(C#N)=C1 |
CAS Datenbank | 160844-75-7(CAS DataBase Reference) |