AC1Q2TOW
8-[(dimethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)chromen-4-one
Also Known As: ChemDiv3_005056|IDI1_022966|8-[(dimethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one|BRD-K58786151-001-01-5|8-(dimethylaminomethyl)-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)chromen-4-one|8-[(dimethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)chro men-4-one|8-[(Dimethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-1-benzopyran-4-one|8-[(DIMETHYLAMINO)METHYL]-3-(4-ETHYLPHENOXY)-7-HYDROXY-2-(TRIFLUOROMETHYL)CHROMEN-4-ONE
| Molecular Formula | C21H20F3NO4 |
|---|---|
| Molecular Weight | 407.13443 g/mol |
| LogP | 4.9337 |
| Topological Polar Surface Area | 62.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.13443 |
| Monoisotopic Mass | 407.13443 |
| Heavy Atoms | 29 |
| Complexity | 1086.2521 |
Chemical Identifiers
| CAS Number | 4159-61-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN(C)C)O)C(F)(F)F |
Product Overview
AC1Q2TOW (CAS 4159-61-9), with molecular formula C21H20F3NO4 and molecular weight 407.13443 g/mol. IUPAC: 8-[(dimethylamino)methyl]-3-(4-ethylphenoxy)-7-hydroxy-2-(trifluoromethyl)chromen-4-one.
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