Compound C12H23NO2S2
7-(diethylcarbamothioylsulfanyl)heptanoic acid
CAS: 73806-70-9
| Molecular Formula | C12H23NO2S2 |
|---|---|
| Molecular Weight | 277.5 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 97.9 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 277.11703 |
| Heavy Atoms | 17 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 73806-70-9 |
|---|---|
| SMILES | CCN(CC)C(=S)SCCCCCCC(=O)O |
| InChIKey | PPXRYGKVZOEKPA-UHFFFAOYSA-N |
📖 Product Overview
Compound C12H23NO2S2 (CAS: 73806-70-9) is a chemical compound with molecular formula C12H23NO2S2 and molecular weight 277.5 g/mol. Its IUPAC systematic name is 7-(diethylcarbamothioylsulfanyl)heptanoic acid.
PPXRYGKVZOEKPA-UHFFFAOYSA-N.
SMILES: CCN(CC)C(=S)SCCCCCCC(=O)O.
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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