Dan 2806
bis(N-(2-benzhydryloxyethyl)-1-(3-methylphenoxy)propan-2-amine);oxalic acid
Also Known As: DAN-2806|DAN 2806|C25H29NO2.1/2C2H2O4|N-(2-(Diphenylmethoxy)ethyl)-1-(3-methylphenoxy)-2-propylamine hemioxalate|C25-H29-N-O2.1/2C2-H2-O4|2-Propylamine, N-(2-(diphenylmethoxy)ethyl)-1-(3-methylphenoxy)-, ethanedioate (2:1)|N-(2-benzhydryloxyethyl)-1-(3-methylphenoxy)propan-2-amine; oxalic acid|Oxalic acid--N-[2-(diphenylmethoxy)ethyl]-1-(3-methylphenoxy)propan-2-amine (1/2)
| Molecular Formula | C52H60N2O8 |
|---|---|
| Molecular Weight | 840.43494 g/mol |
| LogP | 9.47184 |
| Topological Polar Surface Area | 135.58 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 840.43494 |
| Monoisotopic Mass | 840.43494 |
| Heavy Atoms | 62 |
| Complexity | 1905.4193 |
Chemical Identifiers
| CAS Number | 62098-99-1 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCC(C)NCCOC(C2=CC=CC=C2)C3=CC=CC=C3.CC1=CC(=CC=C1)OCC(C)NCCOC(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O |
Product Overview
Dan 2806 (CAS 62098-99-1), with molecular formula C52H60N2O8 and molecular weight 840.43494 g/mol. IUPAC: bis(N-(2-benzhydryloxyethyl)-1-(3-methylphenoxy)propan-2-amine);oxalic acid.
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