Basic information
- Standard SMILES
COC(=O)C1(c2cc(I)c(O)c(I)c2)CC1- InChIKey
VNXMVWSDYKUWNZ-UHFFFAOYSA-N- Molecular formula
- C11H10I2O3
- Average molar mass
- 444 g/mol
Names & identifiers
- Preferred name
- 1-(4-Hydroxy-3,5-diiodo-phenyl)-cyclopropanecarboxylic acid methyl ester
- IUPAC
- methyl 1-(4-hydroxy-3,5-diiodophenyl)cyclopropane-1-carboxylate
Names & synonyms
1-(4-hydroxy-3,5-diiodo-phenyl)-cyclopropanecarboxylic acid methyl esterSCHEMBL1465277VNXMVWSDYKUWNZ-UHFFFAOYSA-N936727-39-8DB-300669
Database identifiers
- PubChem CID
- 59129281
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 279
Related reactions
16 records
Compound notes
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