Basic information
- CAS
824431-85-8- Standard SMILES
Cn1cc(I)nc1C1CC1- InChIKey
FAAQIWWKGLYLMM-UHFFFAOYSA-N- Molecular formula
- C7H9IN2
- Average molar mass
- 248.06 g/mol
- Monoisotopic mass
- 247.98104629
Names & identifiers
- Preferred name
- 2-cyclopropyl-4-iodo-1-methyl-1H-imidazole
- IUPAC
- 2-cyclopropyl-4-iodo-1-methylimidazole
Names & synonyms
2-cyclopropyl-4-iodo-1-methyl-1H-imidazole824431-85-84-Iodo-2-cyclopropyl-1-methyl-1H-imidazoleSCHEMBL1304289DTXSID50621183FAAQIWWKGLYLMM-UHFFFAOYSA-NDA-02590
Database identifiers
- CAS
824431-85-8- PubChem CID
- 21985384
- DTXSID
DTXSID50621183
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 136
Related reactions
4 records
Compound notes
Loading…