AC1LXIN0
3-[7-[(2-chloro-6-fluorophenyl)methoxy]-4,8-dimethyl-2-oxochromen-3-yl]propanoic acid
Also Known As: CBKinase1_006267|CBKinase1_018667|EiM07-28286|3-{7-[(2-chloro-6-fluorobenzyl)oxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoic acid|BRD-K39416580-001-01-4|3-[7-[(2-chloro-6-fluorophenyl)methoxy]-4,8-dimethyl-2-oxochromen-3-yl]propanoic acid|3-(7-((2-chloro-6-fluorobenzyl)oxy)-4,8-dimethyl-2-oxo-2H-chromen-3-yl)propanoic acid|3-[7-[(2-chloro-6-fluoro-phenyl)methoxy]-4,8-dimethyl-2-oxo-chromen-3-yl]propanoic Acid
| Molecular Formula | C21H18ClFO5 |
|---|---|
| Molecular Weight | 404.08267 g/mol |
| LogP | 4.79854 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.08267 |
| Monoisotopic Mass | 404.08267 |
| Heavy Atoms | 28 |
| Complexity | 1099.7095 |
Chemical Identifiers
| CAS Number | 701972-64-7 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC3=C(C=CC=C3Cl)F)CCC(=O)O |
Product Overview
AC1LXIN0 (CAS 701972-64-7), with molecular formula C21H18ClFO5 and molecular weight 404.08267 g/mol. IUPAC: 3-[7-[(2-chloro-6-fluorophenyl)methoxy]-4,8-dimethyl-2-oxochromen-3-yl]propanoic acid.
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