2-Imidazoline, 2-(2-tert-butylphenoxy)methyl-, hydrochloride
Basic information
- CAS
101564-91-4- Standard SMILES
CC(C)(C)c1ccccc1OCC1=NCC[NH2+]1.[Cl-]- InChIKey
BETHWPJVQCLYFC-UHFFFAOYSA-N- Molecular formula
- C14H21ClN2O
- Average molar mass
- 268.78 g/mol
- Monoisotopic mass
- 268.134241
Names & identifiers
- Preferred name
- 2-Imidazoline, 2-(2-tert-butylphenoxy)methyl-, hydrochloride
- IUPAC
- 2-[(2-tert-butylphenoxy)methyl]-4,5-dihydro-1H-imidazol-1-ium chloride
Names & synonyms
101564-91-42-(2-tert-Butylphenoxy)methyl-2-imidazoline hydrochloride2-IMIDAZOLINE, 2-(2-tert-BUTYLPHENOXY)METHYL-, HYDROCHLORIDERefChem:262007
Database identifiers
- CAS
101564-91-4- PubChem CID
- 58532
Properties
Computed structural properties
- Topological polar surface area
- 38.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 280
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Compound notes
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