TL;DR: trans-Deltamethrin (CAS 106454-65-3) is a chemical compound with molecular formula C22H19Br2NO3 and molecular weight 502.97318 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cis-[(S)-cyano-(3-phenoxyphenyl)methyl] (1R,3S)-3-(2,2-dibromoethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Also Known As: trans-Deltamethrin, TRANS-DELTAMETHRIN), 1R,3S,aS-Deltamethrin, 1R,3S,aS-Delta methrin, RU 26979
| Molecular Formula | C22H19Br2NO3 |
| Molecular Weight | 502.97318 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 59.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 502.97318 Da |
| Heavy Atoms | 28 |
| Complexity | 643.0 |
| SMILES | CC1([C@@H]([C@H]1C(=O)O[C@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=C(Br)Br)C |
| InChIKey | OWZREIFADZCYQD-GGPKGHCWSA-N |
The XLogP value of 6.2 indicates that trans-Deltamethrin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.3 Ų, trans-Deltamethrin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-Deltamethrin has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of trans-Deltamethrin is 106454-65-3.
The molecular formula of trans-Deltamethrin is C22H19Br2NO3.
The molecular weight of trans-Deltamethrin is 502.97318 g/mol.
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