Ethyl-2-Ethoxy-1-[[(2'-Cyanobiphenyl-4-yl) Methyl] Benzimidazole]-7-Carboxylate
化学名:Ethyl-2-Ethoxy-1-[[(2'-Cyanobiphenyl-4-yl) Methyl] Benzimidazole]-7-Carboxylate
CAS番号.139481-41-7
英語名:Ethyl-2-Ethoxy-1-[[(2'-Cyanobiphenyl-4-yl) Methyl] Benzimidazole]-7-Carboxylate
CBNumberCB6875000
MFC26H23N3O3
MW425.48
MOL File139481-41-7.mol
Ethyl-2-Ethoxy-1-[[(2'-Cyanobiphenyl-4-yl) Methyl] Benzimidazole]-7-Carboxylate物理性質
沸点 | 637.5±65.0 °C(Predicted) |
比重(密度) | 1.19 |
貯蔵温度 | Sealed in dry,Room Temperature |
溶解性 | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
酸解離定数(Pka) | 4.20±0.10(Predicted) |
外見 | Solid |
色 | White to Off-White |
InChI | InChI=1S/C26H23N3O3/c1-3-31-25(30)22-10-7-11-23-24(22)29(26(28-23)32-4-2)17-18-12-14-19(15-13-18)21-9-6-5-8-20(21)16-27/h5-15H,3-4,17H2,1-2H3 |
InChIKey | GYTTUVXCCHRIBA-UHFFFAOYSA-N |
SMILES | C1(OCC)N(CC2=CC=C(C3=CC=CC=C3C#N)C=C2)C2=C(C(OCC)=O)C=CC=C2N=1 |