Basic information
- CAS
24464-18-4- Standard SMILES
C[NH+]1CCc2c(cccc2-c2ccccc2)C1.[I-]- InChIKey
DDUNIOFHMWGKGP-UHFFFAOYSA-N- Molecular formula
- C16H18IN
- Average molar mass
- 351.22 g/mol
- Monoisotopic mass
- 351.0484
Names & identifiers
- Preferred name
- Isoquinoline, 1,2,3,4-tetrahydro-2-methyl-5-phenyl-, hydriodide
- IUPAC
- 2-methyl-5-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium iodide
Names & synonyms
24464-18-4ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-2-METHYL-5-PHENYL-, HYDRIODIDERefChem:10877302-Methyl-5-phenyl-1,2,3,4-tetrahydroisoquinoline hydriodide
Database identifiers
- CAS
24464-18-4- PubChem CID
- 32407
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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