Isoquinoline, 1,2,3,4-tetrahydro-2-pentyl-, hydrochloride
Basic information
- CAS
7511-64-0- Standard SMILES
CCCCC[NH+]1CCc2ccccc2C1.[Cl-]- InChIKey
JWDYBQGUYYDQGP-UHFFFAOYSA-N- Molecular formula
- C14H22ClN
- Average molar mass
- 239.78 g/mol
- Monoisotopic mass
- 239.1440774
Names & identifiers
- Preferred name
- Isoquinoline, 1,2,3,4-tetrahydro-2-pentyl-, hydrochloride
- IUPAC
- 2-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride
Names & synonyms
ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-2-PENTYL-, HYDROCHLORIDE7511-64-0RefChem:10877332-Amyl-1,2,3,4-tetrahydroisoquinoline hydrochlorideNSC 317551,2,3,4-Tetrahydro-2-pentylisoquinoline hydrochloride
Database identifiers
- CAS
7511-64-0- PubChem CID
- 24137
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 178
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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