Basic information
- Standard SMILES
Oc1ccc(Cc2ncccn2)cc1I- InChIKey
RIQPEFFYEIKPQF-UHFFFAOYSA-N- Molecular formula
- C11H9IN2O
- Average molar mass
- 312.11 g/mol
Names & identifiers
- Preferred name
- 2-Iodo-4-(pyrimidin-2-ylmethyl)phenol
- IUPAC
- 2-iodo-4-(pyrimidin-2-ylmethyl)phenol
Names & synonyms
SCHEMBL1601527RIQPEFFYEIKPQF-UHFFFAOYSA-N2-iodo-4-(pyrimidin-2-ylmethyl)phenol
Database identifiers
- PubChem CID
- 58415247
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 46 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 197
Related reactions
2 records
Compound notes
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