AC1MIER6
bis(3-(anilinomethyl)-1,3-benzoxazol-2-one);nickel(2+);oxalate
Also Known As: Nickel, (ethanedioato(2-)-O,O')bis(3-((phenylamino)methyl)-2(3H)-benzoxazolone-N(sup N(sup 3),O(sup 2))-|3-(anilinomethyl)-1,3-benzoxazol-2-one; nickel(2+); oxalate|3-(anilinomethyl)benzooxazol-2-one; Nickel(+2) Cation; Oxalate|Nickel(2+) ethanedioate--3-(anilinomethyl)-1,3-benzoxazol-2(3H)-one (1/1/2)
CAS: 82497-99-2
| Molecular Formula | C30H24N4NiO8 |
|---|---|
| Molecular Weight | 626.0947 g/mol |
| LogP | 1.8119 |
| Topological Polar Surface Area | 174.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 626.0947 |
| Monoisotopic Mass | 626.0947 |
| Heavy Atoms | 43 |
| Complexity | 1756.6653 |
Chemical Identifiers
| CAS Number | 82497-99-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NCN2C3=CC=CC=C3OC2=O.C1=CC=C(C=C1)NCN2C3=CC=CC=C3OC2=O.C(=O)(C(=O)[O-])[O-].[Ni+2] |
Product Overview
AC1MIER6 (CAS 82497-99-2), with molecular formula C30H24N4NiO8 and molecular weight 626.0947 g/mol. IUPAC: bis(3-(anilinomethyl)-1,3-benzoxazol-2-one);nickel(2+);oxalate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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