Basic information
- CAS
65210-33-5- Standard SMILES
CC1(CC[NH+]2CCCCC2)Oc2ccccc2O1.[Cl-]- InChIKey
ZBRKXDHVSJUMNS-UHFFFAOYSA-N- Molecular formula
- C15H22ClNO2
- Average molar mass
- 283.79 g/mol
- Monoisotopic mass
- 283.1339066
Names & identifiers
- Preferred name
- 1,3-Benzodioxole, 2-methyl-2-(2-piperidinoethyl)-, hydrochloride
- IUPAC
- 1-[2-(2-methyl-1,3-benzodioxol-2-yl)ethyl]piperidin-1-ium chloride
Names & synonyms
2-Methyl-2-(2-piperidinoethyl)-1,3-benzodioxole hydrochloride65210-33-51,3-BENZODIOXOLE, 2-METHYL-2-(2-PIPERIDINOETHYL)-, HYDROCHLORIDERefChem:217860
Database identifiers
- CAS
65210-33-5- PubChem CID
- 47543
Properties
Computed structural properties
- Topological polar surface area
- 22.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 262
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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