Piperidine, 1-(4-allyltetrahydro-2H-thiopyran-4-yl)-, hydrochloride
Basic information
- CAS
21602-62-0- Standard SMILES
C=CCC1(N2CCCCC2)CCSCC1.Cl- InChIKey
QAZFIABGUJBEPC-UHFFFAOYSA-N- Molecular formula
- C13H24ClNS
- Average molar mass
- 261.86 g/mol
- Monoisotopic mass
- 261.1317986
Names & identifiers
- Preferred name
- Piperidine, 1-(4-allyltetrahydro-2H-thiopyran-4-yl)-, hydrochloride
- IUPAC
- 1-(4-prop-2-enylthian-4-yl)piperidine;hydrochloride
Names & synonyms
21602-62-0Piperidine, 1-(4-allyltetrahydro-2H-thiopyran-4-yl)-, hydrochloride1-(4-Allyltetrahydro-2H-thiopyran-4-yl)piperidine hydrochlorideDTXSID80175987RefChem:373095DTXCID50984781-[4-(Prop-2-en-1-yl)thian-4-yl]piperidine--hydrogen chloride (1/1)
Database identifiers
- CAS
21602-62-0- PubChem CID
- 210775
- DTXSID
DTXSID80175987
Properties
Computed structural properties
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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