Basic information
- CAS
40511-31-7- Standard SMILES
CCCCn1cnc(-c2ccc(OC)c(OC)c2)c1.Cl- InChIKey
LGYPUISWZCHRRV-UHFFFAOYSA-N- Molecular formula
- C15H21ClN2O2
- Average molar mass
- 296.79 g/mol
- Monoisotopic mass
- 296.1291556
Names & identifiers
- Preferred name
- 1-Butyl-4-(3,4-dimethoxyphenyl)-1H-imidazole--hydrogen chloride (1/1)
- IUPAC
- 1-butyl-4-(3,4-dimethoxyphenyl)imidazole;hydrochloride
Names & synonyms
40511-31-7DTXSID409609171-Butyl-4-(3,4-dimethoxyphenyl)-1H-imidazole--hydrogen chloride (1/1)RefChem:1055176DTXCID401388758Verbindungen 305 [German]1-Butyl-4-(3,4-dimethoxyphenyl)imidazole hydrochlorideVerbindungen 305Imidazole, 1-butyl-4-(3,4-dimethoxyphenyl)-, hydrochloride
Database identifiers
- CAS
40511-31-7- PubChem CID
- 218355
- DTXSID
DTXSID40960917
Properties
Computed structural properties
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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