Tralomethrine
cis-[(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3S)-2,2-dimethyl-3-(1,2,2,2-tetrabromoethyl)cyclopropane-1-carboxylate
| Molecular Formula | C22H19Br4NO3 |
|---|---|
| Molecular Weight | 665.0 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 59.3 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 664.8057 |
| Heavy Atoms | 30 |
| Complexity | 665.0 |
Chemical Identifiers
| CAS Number | 1375081-91-6 |
|---|---|
| SMILES | CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C(C(Br)(Br)Br)Br)C |
| InChIKey | YWSCPYYRJXKUDB-KAKFPZCNSA-N |
📖 Product Overview
Tralomethrine (CAS: 1375081-91-6) is a chemical compound with molecular formula C22H19Br4NO3 and molecular weight 665.0 g/mol. Its IUPAC systematic name is cis-[(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3S)-2,2-dimethyl-3-(1,2,2,2-tetrabromoethyl)cyclopropane-1-carboxylate.
YWSCPYYRJXKUDB-KAKFPZCNSA-N.
SMILES: CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C(C(Br)(Br)Br)Br)C.
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