Basic information
- Standard SMILES
COC(=O)C=CC(C)(C)CCCCn1ccnc1- InChIKey
UVGCRUDETLMZOD-UHFFFAOYSA-N- Molecular formula
- C14H22N2O2
- Average molar mass
- 250.34 g/mol
- Monoisotopic mass
- 250.16812795
Names & identifiers
- Preferred name
- Methyl 8-imidazol-1-yl-4,4-dimethyloct-2-enoate
- IUPAC
- methyl 8-imidazol-1-yl-4,4-dimethyloct-2-enoate
Names & synonyms
SCHEMBL11270122
Database identifiers
- PubChem CID
- 54374083
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 288
Related reactions
1 records
Compound notes
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