AC1OAKNM
4-[[2-methoxy-6-[(E)-1,2,4-triazol-4-yliminomethyl]phenoxy]methyl]benzoic acid
Also Known As: SR-01000258457-1|4-({2-methoxy-6-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]phenoxy}methyl)benzoic acid|(E)-4-((2-(((4H-1,2,4-triazol-4-yl)imino)methyl)-6-methoxyphenoxy)methyl)benzoic acid|4-[[2-methoxy-6-(1,2,4-triazol-4-yliminomethyl)phenoxy]methyl]benzoic Acid|4-[[2-methoxy-6-[(E)-1,2,4-triazol-4-yliminomethyl]phenoxy]methyl]benzoic acid
CAS: 690969-89-2
| Molecular Formula | C18H16N4O4 |
|---|---|
| Molecular Weight | 352.11716 g/mol |
| LogP | 2.4461 |
| Topological Polar Surface Area | 98.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 352.11716 |
| Monoisotopic Mass | 352.11716 |
| Heavy Atoms | 26 |
| Complexity | 905.4503 |
Chemical Identifiers
| CAS Number | 690969-89-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1OCC2=CC=C(C=C2)C(=O)O)/C=N/N3C=NN=C3 |
Product Overview
AC1OAKNM (CAS 690969-89-2), with molecular formula C18H16N4O4 and molecular weight 352.11716 g/mol. IUPAC: 4-[[2-methoxy-6-[(E)-1,2,4-triazol-4-yliminomethyl]phenoxy]methyl]benzoic acid.
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.
View MSDS →
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