trans-[cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
trans-[cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
| Molecular Formula | C22H19F2NO3 |
|---|---|
| Molecular Weight | 383.4 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 59.3 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.1333 |
| Heavy Atoms | 28 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 67670-66-0 |
|---|---|
| SMILES | CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(F)F)C |
| InChIKey | FWHRNWVIAOTDRA-IMBCPYESSA-N |
📖 Product Overview
trans-[cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate (CAS: 67670-66-0) is a chemical compound with molecular formula C22H19F2NO3 and molecular weight 383.4 g/mol. Its IUPAC systematic name is trans-[cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-difluoroethenyl)-2,2-dimethylcyclopropane-1-carboxylate.
FWHRNWVIAOTDRA-IMBCPYESSA-N.
SMILES: CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(F)F)C.
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