AC1MB4C4
methyl 4-[[2-[(E)-2-cyano-3-(2-fluoroanilino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoate
Also Known As: methyl 4-[(2-{2-cyano-2-[(2-fluorophenyl)carbamoyl]eth-1-en-1-yl}phenoxy)methyl]benzoate|Methyl 4-[[2-[(E)-2-cyano-2-[(2-fluorophenyl)carbamoyl]ethenyl]phenoxy]methyl]benzoate|methyl 4-[[2-[(E)-2-cyano-3-(2-fluoroanilino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoate
CAS: 564458-32-8
| Molecular Formula | C25H19FN2O4 |
|---|---|
| Molecular Weight | 430.13287 g/mol |
| LogP | 4.73698 |
| Topological Polar Surface Area | 88.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.13287 |
| Monoisotopic Mass | 430.13287 |
| Heavy Atoms | 32 |
| Complexity | 1197.0638 |
Chemical Identifiers
| CAS Number | 564458-32-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2/C=C(\C#N)/C(=O)NC3=CC=CC=C3F |
Product Overview
AC1MB4C4 (CAS 564458-32-8), with molecular formula C25H19FN2O4 and molecular weight 430.13287 g/mol. IUPAC: methyl 4-[[2-[(E)-2-cyano-3-(2-fluoroanilino)-3-oxoprop-1-enyl]phenoxy]methyl]benzoate.
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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