Alfatox
diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-lambda5-phosphane;1-methoxy-4-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]benzene
| Molecular Formula | C28H36Cl3N2O5PS |
|---|---|
| Molecular Weight | 650.0 g/mol |
| Topological Polar Surface Area | 104.0 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 648.1148 |
| Heavy Atoms | 40 |
| Complexity | 586.0 |
Chemical Identifiers
| CAS Number | 59928-80-2 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C.COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)C(Cl)(Cl)Cl |
| InChIKey | XBNABDZOOVCLGU-UHFFFAOYSA-N |
📖 Product Overview
Alfatox (CAS: 59928-80-2) is a chemical compound with molecular formula C28H36Cl3N2O5PS and molecular weight 650.0 g/mol. Its IUPAC systematic name is diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-lambda5-phosphane;1-methoxy-4-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]benzene.
XBNABDZOOVCLGU-UHFFFAOYSA-N.
SMILES: CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C.COC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)C(Cl)(Cl)Cl.
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