Ammonium, (2-hydroxyethyl)triethyl-, iodide, 3,3-diphenyl-3-hydroxypropionate
Basic information
- CAS
57343-50-7- Standard SMILES
CC[N+](CC)(CC)CCOC(=O)CC(O)(c1ccccc1)c1ccccc1.[I-]- InChIKey
RZXIPKMNSFGTFN-UHFFFAOYSA-M- Molecular formula
- C23H32INO3
- Average molar mass
- 497.4 g/mol
- Monoisotopic mass
- 497.14269
Names & identifiers
- Preferred name
- Ammonium, (2-hydroxyethyl)triethyl-, iodide, 3,3-diphenyl-3-hydroxypropionate
- IUPAC
- triethyl-[2-(3-hydroxy-3,3-diphenylpropanoyl)oxyethyl]azanium iodide
Names & synonyms
DPE-ethyl iodideAMMONIUM, (2-HYDROXYETHYL)TRIETHYL-, IODIDE, 3,3-DIPHENYL-3-HYDROXYPROPIONATE57343-50-7RefChem:318805DTXSID60972850N,N,N-Triethyl-2-[(3-hydroxy-3,3-diphenylpropanoyl)oxy]ethan-1-aminium iodide
Database identifiers
- CAS
57343-50-7- PubChem CID
- 42277
- DTXSID
DTXSID60972850
Properties
Computed structural properties
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 409
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…