AC1MV9V0
4-ethylsulfanylspiro[5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-3-ium-2,1'-cyclohexane]
Also Known As: 4-(ethylsulfanyl)-5,6,7,8-tetrahydro-1H-spiro[1-benzothieno[2,3-d]pyrimidin-3-ium-2,1'-cyclohexane]|4-(Ethylsulfanyl)-5,6,7,8-tetrahydro-1H-spiro[[1]benzothieno[2,3-d]pyrimidin-3-ium-2,1'-cyclohexane]|4-ethylsulfanylspiro[5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-3-ium-2,1'-cyclohexane]
CAS: 6572-55-0
| Molecular Formula | C17H25N2S2+ |
|---|---|
| Molecular Weight | 321.1459 g/mol |
| LogP | 3.2931 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 321.1459 |
| Monoisotopic Mass | 321.1459 |
| Heavy Atoms | 21 |
| Complexity | 567.5904 |
Chemical Identifiers
| CAS Number | 6572-55-0 |
|---|---|
| SMILES | CCSC1=[NH+]C2(CCCCC2)NC3=C1C4=C(S3)CCCC4 |
Product Overview
AC1MV9V0 (CAS 6572-55-0), with molecular formula C17H25N2S2+ and molecular weight 321.1459 g/mol. IUPAC: 4-ethylsulfanylspiro[5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-3-ium-2,1'-cyclohexane].
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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