Basic information
- CAS
25433-53-8- Standard SMILES
C[N+](C)(C)C(CCc1ccco1)c1ccccc1.[I-]- InChIKey
YBCFMZHRGULRFC-UHFFFAOYSA-M- Molecular formula
- C16H22INO
- Average molar mass
- 371.26 g/mol
- Monoisotopic mass
- 371.07461
Names & identifiers
- Preferred name
- 3-(Furan-2-yl)-N,N,N-trimethyl-1-phenylpropan-1-aminium iodide
- IUPAC
- [3-(furan-2-yl)-1-phenylpropyl]-trimethylazanium iodide
Names & synonyms
3-(furan-2-yl)-n,n,n-trimethyl-1-phenylpropan-1-aminium iodideDTXSID6094829725433-53-8RefChem:1067150DTXCID201376531Ammonium, (3-(2-furyl)-1-phenylpropyl)trimethyl-, iodide(3-(2-Furyl)-1-phenylpropyl)trimethylammonium iodide(alpha-(2-(2-Furyl)ethyl)benzyl)trimethylammonium iodideAmmonium, (alpha-(2-(2-furyl)ethyl)benzyl)trimethyl-, iodide
Database identifiers
- CAS
25433-53-8- PubChem CID
- 212959
- DTXSID
DTXSID60948297
Properties
Computed structural properties
- Topological polar surface area
- 13.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 240
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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