Basic information
- CAS
25433-46-9- Standard SMILES
CC(CCc1ccco1)[N+](C)(C)Cc1ccccc1.[I-]- InChIKey
KXPXNYJQVCZQEJ-UHFFFAOYSA-M- Molecular formula
- C17H24INO
- Average molar mass
- 385.28 g/mol
- Monoisotopic mass
- 385.09026
Names & identifiers
- Preferred name
- N-Benzyl-4-(furan-2-yl)-N,N-dimethylbutan-2-aminium iodide
- IUPAC
- benzyl-[4-(furan-2-yl)butan-2-yl]-dimethylazanium iodide
Names & synonyms
25433-46-9DTXSID40948290N-benzyl-4-(furan-2-yl)-N,N-dimethylbutan-2-aminium iodideRefChem:1091591DTXCID701376524Benzyldimethyl(4-(2-furyl)-2-butyl)ammonium iodideBenzyldimethyl(3-(2-furyl)-1-methylpropyl)ammonium iodideAMMONIUM, BENZYLDIMETHYL(4-(2-FURYL)-2-BUTYL)-, IODIDE
Database identifiers
- CAS
25433-46-9- PubChem CID
- 32975
- DTXSID
DTXSID40948290
Properties
Computed structural properties
- Topological polar surface area
- 13.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 258
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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