Basic information
- Standard SMILES
COc1ccc(C=O)cc1-c1ccnc(Cl)n1- InChIKey
MIMCVINWZDNHMV-UHFFFAOYSA-N- Molecular formula
- C12H9ClN2O2
- Average molar mass
- 248.66 g/mol
Names & identifiers
- Preferred name
- 3-(2-Chloropyrimidin-4-yl)-4-methoxybenzaldehyde
- IUPAC
- 3-(2-chloropyrimidin-4-yl)-4-methoxybenzaldehyde
Names & synonyms
3-(2-chloropyrimidin-4-yl)-4-methoxybenzaldehyde859518-09-5SCHEMBL3399379MIMCVINWZDNHMV-UHFFFAOYSA-NDB-1505213-(2-chloropyrimidin-4-yl)4-methoxybenzaldehyde3-(2-Chloro-4-pyrimidinyl)-4-methoxybenzaldehyde
Database identifiers
- PubChem CID
- 24901876
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 265
Related reactions
2 records
Compound notes
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