Basic information
- CAS
64048-46-0- Standard SMILES
CC[N+](CC)(CC)CCOC(=O)Cc1ccc(-c2ccccc2)cc1.[I-]- InChIKey
BYFIASYPXXINDD-UHFFFAOYSA-M- Molecular formula
- C22H30INO2
- Average molar mass
- 467.4 g/mol
- Monoisotopic mass
- 467.13213
Names & identifiers
- Preferred name
- Ammonium, (2-hydroxyethyl)triethyl-, iodide, 4-biphenylylacetate
- IUPAC
- triethyl-[2-[2-(4-phenylphenyl)acetyl]oxyethyl]azanium iodide
Names & synonyms
64048-46-0(2-Hydroxyethyl)triethylammonium iodide 4-biphenylylacetateM.G. 1047Ammonium, (2-(p-biphenylylacetoxy)ethyl)triethyl-, iodideIoduro di trietil-(beta-difenil-4-acetossi-etil)ammonio [Italian]AMMONIUM, (2-HYDROXYETHYL)TRIETHYL-, IODIDE, 4-BIPHENYLYLACETATEEthanaminium, 2-(((1,1'-biphenyl)-4-ylacetyl)oxy)-N,N,N-triethyl-, iodideIoduro di trietil-(beta-difenil-4-acetossi-etil)ammonioRefChem:318806DTXSID609822772-{[([1,1'-Biphenyl]-4-yl)acetyl]oxy}-N,N,N-triethylethan-1-aminium iodide
Database identifiers
- CAS
64048-46-0- PubChem CID
- 46785
- DTXSID
DTXSID60982277
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 369
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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