Buthiobate
1-[(4-tert-butylphenyl)methylsulfanyl]-1-butylsulfanyl-N-pyridin-3-ylmethanimine
| Molecular Formula | C21H28N2S2 |
|---|---|
| Molecular Weight | 372.6 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 75.9 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 372.1694 |
| Heavy Atoms | 25 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 51308-54-4 |
|---|---|
| SMILES | CCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C |
| InChIKey | ZZVVDIVWGXTDRQ-UHFFFAOYSA-N |
📖 Product Overview
Buthiobate (CAS: 51308-54-4) is a chemical compound with molecular formula C21H28N2S2 and molecular weight 372.6 g/mol. Its IUPAC systematic name is 1-[(4-tert-butylphenyl)methylsulfanyl]-1-butylsulfanyl-N-pyridin-3-ylmethanimine.
ZZVVDIVWGXTDRQ-UHFFFAOYSA-N.
SMILES: CCCCSC(=NC1=CN=CC=C1)SCC2=CC=C(C=C2)C(C)(C)C.
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