2,6-Dimethylanilinium
Basic information
- CAS
107556-92-3- Standard SMILES
Cc1cccc(C)c1[NH3+]- InChIKey
UFFBMTHBGFGIHF-UHFFFAOYSA-O- Molecular formula
- C8H12N+
- Average molar mass
- 122.19 g/mol
- Monoisotopic mass
- 122.09697439
Names & identifiers
- Preferred name
- 2,6-Dimethylanilinium
- IUPAC
- (2,6-dimethylphenyl)azanium
Names & synonyms
2,6-dimethylanilinium107556-92-3DTXSID40762711
Database identifiers
- CAS
107556-92-3- PubChem CID
- 4990787
- Nikkaji
- J136.990C
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 1
- Complexity
- 80.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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