Benzimidazole-3-ethylamine, N-p-methoxybenzyl-, dioxalate
2-(3H-benzimidazol-1-ium-1-yl)ethyl-[(4-methoxyphenyl)methyl]azanium;bis(2-hydroxy-2-oxoacetate)
Also Known As: AC1L1UHS|RefChem:325989|N-p-Methoxybenzyl-benzimidazole-3-ethylamine dioxalate|BENZIMIDAZOLE-3-ETHYLAMINE, N-p-METHOXYBENZYL-, DIOXALATE|2-(3H-benzimidazol-1-ium-1-yl)ethyl-[(4-methoxyphenyl)methyl]azanium; 2-hydroxy-2-oxoacetate|3-(2-{[(4-Methoxyphenyl)methyl]azaniumyl}ethyl)-1H-1,3-benzimidazol-3-ium bis(hydrogen ethanedioate)
| Molecular Formula | C21H23N3O9 |
|---|---|
| Molecular Weight | 461.14343 g/mol |
| LogP | -3.13 |
| Topological Polar Surface Area | 200.37 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 461.14343 |
| Heavy Atoms | 33 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 31488-82-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C[NH2+]CC[N+]2=CNC3=CC=CC=C32.C(=O)(C(=O)[O-])O.C(=O)(C(=O)[O-])O |
Product Overview
Benzimidazole-3-ethylamine, N-p-methoxybenzyl-, dioxalate (CAS 31488-82-1), with molecular formula C21H23N3O9 and molecular weight 461.14343 g/mol. IUPAC: 2-(3H-benzimidazol-1-ium-1-yl)ethyl-[(4-methoxyphenyl)methyl]azanium;bis(2-hydroxy-2-oxoacetate).
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