2-Imidazoline, 2-((2,3-xylyloxy)methyl)-, hydrochloride
Basic information
- CAS
67400-55-9- Standard SMILES
Cc1cccc(OCC2=NCC[NH2+]2)c1C.[Cl-]- InChIKey
LELKGAJQEDPGIO-UHFFFAOYSA-N- Molecular formula
- C12H17ClN2O
- Average molar mass
- 240.73 g/mol
- Monoisotopic mass
- 240.1029409
Names & identifiers
- Preferred name
- 2-Imidazoline, 2-((2,3-xylyloxy)methyl)-, hydrochloride
- IUPAC
- 2-[(2,3-dimethylphenoxy)methyl]-4,5-dihydro-1H-imidazol-1-ium chloride
Names & synonyms
2-((2,3-Dimethylphenoxy)methyl)-2-imidazoline hydrochloride2-IMIDAZOLINE, 2-((2,3-XYLYLOXY)METHYL)-, HYDROCHLORIDE67400-55-9RefChem:261991
Database identifiers
- CAS
67400-55-9- PubChem CID
- 49834
Properties
Computed structural properties
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 240
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Compound notes
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