Basic information
- CAS
40405-77-4- Standard SMILES
CCCOc1ccc(-c2cn(C)cn2)cc1.Cl- InChIKey
CRHHGOLUFWXUQM-UHFFFAOYSA-N- Molecular formula
- C13H17ClN2O
- Average molar mass
- 252.74 g/mol
- Monoisotopic mass
- 252.1029409
Names & identifiers
- Preferred name
- Imidazole, 4-(p-propoxyphenyl)-1-methyl-, hydrochloride
- IUPAC
- 1-methyl-4-(4-propoxyphenyl)imidazole;hydrochloride
Names & synonyms
Verbindungen 331 [German]Verbindungen 331Imidazole, 4-(p-propoxyphenyl)-1-methyl-, hydrochloride40405-77-41-Methyl-4-(p-propoxyphenyl)imidazole hydrochlorideDTXSID50193416RefChem:348870DTXCID601159071-Methyl-4-(4-propoxyphenyl)-1H-imidazole--hydrogen chloride (1/1)
Database identifiers
- CAS
40405-77-4- PubChem CID
- 218249
- DTXSID
DTXSID50193416
Properties
Computed structural properties
- Topological polar surface area
- 27.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 202
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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