1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester
- Product Name1-Methyl-5-nitro-1H-benzimidazole-2-butanoic Acid Ethyl Ester
- CAS3543-72-4
- MFC14H17N3O4
- MW291.3
- EINECS686-742-1
- MOL File3543-72-4.mol
Chemical Properties
Melting point | 100-104°C |
Boiling point | 481.0±25.0 °C(Predicted) |
Density | 1.30±0.1 g/cm3(Predicted) |
storage temp. | 2-8°C |
solubility | Dichloromethane, Ethyl Acetate, Methanol |
form | Solid |
pka | 3.78±0.10(Predicted) |
color | Brown |
InChI | InChI=1S/C14H17N3O4/c1-3-21-14(18)6-4-5-13-15-11-9-10(17(19)20)7-8-12(11)16(13)2/h7-9H,3-6H2,1-2H3 |
InChIKey | VJVBGSJZBDBEIF-UHFFFAOYSA-N |
SMILES | C1(CCCC(OCC)=O)N(C)C2=CC=C([N+]([O-])=O)C=C2N=1 |