Basic information
- CAS
27958-43-6- Standard SMILES
C[N+](C)(C)CCCc1ccc(O)cc1.[I-]- InChIKey
BVSZXTDXKQADJN-UHFFFAOYSA-N- Molecular formula
- C12H20INO
- Average molar mass
- 321.2 g/mol
- Monoisotopic mass
- 321.05896
Names & identifiers
- Preferred name
- Ammonium, (3-(p-hydroxyphenyl)propyl)trimethyl-, iodide
- IUPAC
- 3-(4-hydroxyphenyl)propyl-trimethylazanium iodide
Names & synonyms
(3-(p-Hydroxyphenyl)propyl)trimethylammonium iodide27958-43-6Dimethyl-gamma-(4-hydroxyphenyl)-n-propylamineBenzenepropanaminium, 4-hydroxy-N,N,N-trimethyl-, iodideAMMONIUM, (3-(p-HYDROXYPHENYL)PROPYL)TRIMETHYL-, IODIDERefChem:318849
Database identifiers
- CAS
27958-43-6- PubChem CID
- 34079
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 154
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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