1-Ethyl-2,3-dimethylimidazolium
Basic information
- CAS
131097-15-9- Standard SMILES
CCn1cc[n+](C)c1C- InChIKey
IRGDPGYNHSIIJJ-UHFFFAOYSA-N- Molecular formula
- C7H13N2+
- Average molar mass
- 125.19 g/mol
- Monoisotopic mass
- 125.10787342
Names & identifiers
- Preferred name
- 1-Ethyl-2,3-dimethylimidazolium
- IUPAC
- 1-ethyl-2,3-dimethylimidazol-3-ium
Names & synonyms
1-ETHYL-2,3-DIMETHYLIMIDAZOLIUMDTXSID30861449131097-15-9RefChem:230228DTXCID40197362SCHEMBL294563SCHEMBL294564CHEMBL33059673-Ethyl-1,2-dimethyl-1H-imidazol-3-ium
Database identifiers
- CAS
131097-15-9- PubChem CID
- 2734166
- DTXSID
DTXSID30861449- ChEMBL
CHEMBL3305967- Nikkaji
- J720.081A
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 8.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 1
- Complexity
- 92.9
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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