Basic information
- Standard SMILES
COc1nccc(/C=C/c2ccccc2)n1- InChIKey
BNLBNWHDEBCCOP-BQYQJAHWSA-N- Molecular formula
- C13H12N2O
- Average molar mass
- 212.25 g/mol
- Monoisotopic mass
- 212.09496301
Names & identifiers
- Preferred name
- (E)-2-Methoxy-4-styrylpyrimidine
- IUPAC
- 2-methoxy-4-[(E)-2-phenylethenyl]pyrimidine
Names & synonyms
SCHEMBL990416BNLBNWHDEBCCOP-BQYQJAHWSA-N(E)-2-Methoxy-4-styrylpyrimidine
Database identifiers
- PubChem CID
- 58093422
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 224
Related reactions
2 records
Compound notes
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