Basic information
- Standard SMILES
CCc1nc(C)cn1Cc1ccc(C(=O)OC)cc1- InChIKey
BLKWORMGEOZZSP-UHFFFAOYSA-N- Molecular formula
- C15H18N2O2
- Average molar mass
- 258.32 g/mol
- Monoisotopic mass
- 258.13682782
Names & identifiers
- Preferred name
- Methyl 4-[[2-ethyl-4-methyl-1H-imidazol-1-yl]methyl]benzoate
- IUPAC
- methyl 4-[(2-ethyl-4-methylimidazol-1-yl)methyl]benzoate
Names & synonyms
SCHEMBL9138913BLKWORMGEOZZSP-UHFFFAOYSA-NMethyl 4-[[2-ethyl-4-methyl-1H-imidazol-1-yl]methyl]benzoate
Database identifiers
- PubChem CID
- 20093489
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 301
Related reactions
3 records
Compound notes
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