Basic information
- CAS
2238-73-5- Standard SMILES
C=CCC(O)(CC[N+](C)(C)C)c1ccc(Cl)cc1.[I-]- InChIKey
NKCDLPBQSRJHPJ-UHFFFAOYSA-M- Molecular formula
- C15H23ClINO
- Average molar mass
- 395.7 g/mol
- Monoisotopic mass
- 395.05129
Names & identifiers
- Preferred name
- 3-(4-Chlorophenyl)-3-hydroxy-N,N,N-trimethylhex-5-en-1-aminium iodide
- IUPAC
- [3-(4-chlorophenyl)-3-hydroxyhex-5-enyl]-trimethylazanium iodide
Names & synonyms
2238-73-5DTXSID609450293-(4-Chlorophenyl)-3-hydroxy-N,N,N-trimethylhex-5-en-1-aminium iodideRefChem:1066816DTXCID701373356(3-(p-Chlorophenyl)-3-hydroxy-5-hexenyl)trimethylammonium iodideAMMONIUM, (3-(p-CHLOROPHENYL)-3-HYDROXY-5-HEXENYL)TRIMETHYL-, IODIDE
Database identifiers
- CAS
2238-73-5- PubChem CID
- 16707
- DTXSID
DTXSID60945029
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 266
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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