Basic information
- Standard SMILES
ICCOc1ccc(Cc2ccc(-c3ncco3)cc2)cc1- InChIKey
KTLQZSUKXXVMNX-UHFFFAOYSA-N- Molecular formula
- C18H16INO2
- Average molar mass
- 405.2 g/mol
Names & identifiers
- Preferred name
- 2-[4-[[4-(2-Iodoethoxy)phenyl]methyl]phenyl]oxazole
- IUPAC
- 2-[4-[[4-(2-iodoethoxy)phenyl]methyl]phenyl]-1,3-oxazole
Names & synonyms
SCHEMBL3040623KTLQZSUKXXVMNX-UHFFFAOYSA-N2-[4-[[4-(2-iodoethoxy)phenyl]methyl]phenyl]oxazole
Database identifiers
- PubChem CID
- 68489593
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 312
Related reactions
8 records
Compound notes
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