AC1L4KM5
trans-[(S)-cyano-[3-(2-hydroxyphenoxy)phenyl]methyl] (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Also Known As: Cyano[3-(2-hydroxyphenoxy)phenyl]methyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate|(S)-Cyano[3-(2-hydroxyphenoxy)phenyl]methyl (1R,3R)-3-(2,2-dichloroethen-1-yl)-2,2-dimethylcyclopropane-1-carboxylate|[(S)-cyano-[3-(2-hydroxyphenoxy)phenyl]methyl] (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate|Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, cyano(3-(2-hydroxyphenoxy)phenyl)methyl ester, (1R-(1alpha(S*),3alpha))-
| Molecular Formula | C22H19Cl2NO4 |
|---|---|
| Molecular Weight | 431.06912 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 79.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 431.06912 |
| Monoisotopic Mass | 431.06912 |
| Heavy Atoms | 29 |
| Complexity | 682.0 |
Chemical Identifiers
| CAS Number | 82079-72-9 |
|---|---|
| SMILES | CC1([C@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3O)C=C(Cl)Cl)C |
| InChIKey | FFAGBCCTHSOSFE-CVAIRZPRSA-N |
Product Overview
AC1L4KM5 (CAS 82079-72-9), with molecular formula C22H19Cl2NO4 and molecular weight 431.06912 g/mol. IUPAC: trans-[(S)-cyano-[3-(2-hydroxyphenoxy)phenyl]methyl] (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate.