Basic information
- CAS
21436-97-5- Standard SMILES
Cc1cc(C)c([NH3+])cc1C.[Cl-]- InChIKey
HPSNPQBFMPYUOD-UHFFFAOYSA-N- Molecular formula
- C9H14ClN
- Average molar mass
- 171.67 g/mol
- Monoisotopic mass
- 171.0814771
Overview
See also: Benzenamine, 2,4,5-trimethyl-, hydrochloride (1:1) (preferred).
Names & identifiers
- Preferred name
- (2,4,5-Trimethylphenyl)azanium;chloride
- IUPAC
- (2,4,5-trimethylphenyl)azanium chloride
Names & synonyms
(2,4,5-trimethylphenyl)azanium;chloride
Database identifiers
- CAS
21436-97-5- PubChem CID
- 30628
Properties
Computed structural properties
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 111
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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