Azocine, octahydro-1-(thioxo(3,4,5-trimethoxyphenyl)methyl)-
azocan-1-yl-(3,4,5-trimethoxyphenyl)methanethione
Also Known As: Azocine, octahydro-1-(thioxo(3,4,5-trimethoxyphenyl)methyl)-|5-20-04-00162 (Beilstein Handbook Reference)|Octahydro-1-(thioxo(3,4,5-trimethoxyphenyl)methyl)azocine|(Azocan-1-yl)(3,4,5-trimethoxyphenyl)methanethione|azocan-1-yl-(3,4,5-trimethoxyphenyl)methanethione
CAS: 70733-81-2
| Molecular Formula | C17H25NO3S |
|---|---|
| Molecular Weight | 323.15552 g/mol |
| LogP | 3.654 |
| Topological Polar Surface Area | 30.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 323.15552 |
| Monoisotopic Mass | 323.15552 |
| Heavy Atoms | 22 |
| Complexity | 485.62067 |
Chemical Identifiers
| CAS Number | 70733-81-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=S)N2CCCCCCC2 |
Product Overview
Azocine, octahydro-1-(thioxo(3,4,5-trimethoxyphenyl)methyl)- (CAS 70733-81-2), with molecular formula C17H25NO3S and molecular weight 323.15552 g/mol. IUPAC: azocan-1-yl-(3,4,5-trimethoxyphenyl)methanethione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Azocine, octahydro-1-(thioxo(3,4,5-trimethoxyphenyl)methyl)- is a custom synthesis product. We offer services from milligram to kilogram scale.
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