Piperidinium, 1,1-dimethyl-3-(di-2-thienylmethylene)-5-hydroxy-, bromide
Basic information
- CAS
38795-19-6- Standard SMILES
C[N+]1(C)CC(=C(c2cccs2)c2cccs2)CC(O)C1.[Br-]- InChIKey
GXSIPHIDXCCXTL-UHFFFAOYSA-M- Molecular formula
- C16H20BrNOS2
- Average molar mass
- 386.4 g/mol
- Monoisotopic mass
- 385.01697
Names & identifiers
- Preferred name
- Piperidinium, 1,1-dimethyl-3-(di-2-thienylmethylene)-5-hydroxy-, bromide
- IUPAC
- 5-(dithiophen-2-ylmethylidene)-1,1-dimethylpiperidin-1-ium-3-ol bromide
- English name
- 5-(dithiophen-2-ylmethylidene)-1,1-dimethyl-2,3,4,6-tetrahydropyridin- 3-ol bromide
- Molecular formula
- C16H20BrNOS2
- Molecular weight
- 0
Names & synonyms
38795-19-61,1-Dimethyl-3-(di-2-thienylmethylene)-5-hydroxy-piperidinium bromidePiperidinium, 1,1-dimethyl-3-(di-2-thienylmethylene)-5-hydroxy-, bromideRefChem:373369DTXSID009596003-[Di(thiophen-2-yl)methylidene]-5-hydroxy-1,1-dimethylpiperidin-1-ium bromide5-(dithiophen-2-ylmethylidene)-1,1-dimethyl-2,3,4,6-tetrahydropyridin- 3-ol bromide
Database identifiers
- CAS
38795-19-6- PubChem CID
- 217402
- DTXSID
DTXSID00959600
Properties
Computed structural properties
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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