Basic information
- Standard SMILES
O=Cc1cc(I)ccc1Oc1ccc(OCCO)cc1- InChIKey
DMLINKKLQQBJOS-UHFFFAOYSA-N- Molecular formula
- C15H13IO4
- Average molar mass
- 384.16 g/mol
- Monoisotopic mass
- 383.98586
Names & identifiers
- Preferred name
- 2-[4-(2-Hydroxy-ethoxy)-phenoxy]-5-iodo-benzaldehyde
- IUPAC
- 2-[4-(2-hydroxyethoxy)phenoxy]-5-iodobenzaldehyde
Names & synonyms
SCHEMBL274272DMLINKKLQQBJOS-UHFFFAOYSA-N2-[4-(2-hydroxy-ethoxy)-phenoxy]-5-iodo-benzaldehyde
Database identifiers
- PubChem CID
- 57743316
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 292
Related reactions
2 records
Compound notes
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