Basic information
- CAS
6634-20-4- Standard SMILES
CN(C)CCCN1CC2CC=CCC2C1.Cl- InChIKey
GPXWNTQDNIKBHE-UHFFFAOYSA-N- Molecular formula
- C13H25ClN2
- Average molar mass
- 244.8 g/mol
- Monoisotopic mass
- 244.1706265
Names & identifiers
- Preferred name
- 3-(1,3,3a,4,7,7a-Hexahydro-2H-isoindol-2-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
- IUPAC
- 3-(1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-N,N-dimethylpropan-1-amine;hydrochloride
Names & synonyms
6634-20-4DTXSID10712485NSC51820NSC-518203-(1,3,3a,4,7,7a-Hexahydro-2H-isoindol-2-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
6634-20-4- PubChem CID
- 54598524
- DTXSID
DTXSID10712485
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 207
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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