Basic information
- CAS
133485-56-0- Standard SMILES
CCCCc1ncc(C=O)n1Cc1ccccc1Cl- InChIKey
VYLHMXUTTRBZEK-UHFFFAOYSA-N- Molecular formula
- C15H17ClN2O
- Average molar mass
- 276.76 g/mol
- Monoisotopic mass
- 276.10294084
Names & identifiers
- Preferred name
- 1H-Imidazole-5-carboxaldehyde, 2-butyl-1-[(2-chlorophenyl)methyl]-
- IUPAC
- 2-butyl-3-[(2-chlorophenyl)methyl]imidazole-4-carbaldehyde
Names & synonyms
133485-56-01H-Imidazole-5-carboxaldehyde, 2-butyl-1-[(2-chlorophenyl)methyl]-SCHEMBL6960759DTXSID30435765VYLHMXUTTRBZEK-UHFFFAOYSA-N2-Butyl-1-[(2-chlorophenyl)methyl]-1H-imidazole-5-carbaldehyde2-n-butyl-1-(2-chlorophenyl)methyl-1H-imidazol-5-carboxaldehyde2-n-butyl-1-(2-chlorophenyl)methyl-1H-imidazole-5-carboxaldehyde2-n-butyl-1-[(2-chlorophenyl)methyl]-1H-imidazol-5-carboxaldehyde
Database identifiers
- CAS
133485-56-0- PubChem CID
- 10107530
- DTXSID
DTXSID30435765
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 287
Related reactions
34 records
Compound notes
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