4-Formylpyrimidine-2-carbonitrile
Basic information
- CAS
145276-04-6- Standard SMILES
N#Cc1nccc(C=O)n1- InChIKey
AIDBODRILYHJIB-UHFFFAOYSA-N- Molecular formula
- C6H3N3O
- Average molar mass
- 133.11 g/mol
- Monoisotopic mass
- 133.02761173
Names & identifiers
- Preferred name
- 4-Formylpyrimidine-2-carbonitrile
- IUPAC
- 4-formylpyrimidine-2-carbonitrile
- English name
- 2-Pyrimidinecarbonitrile, 4-formyl- (9CI)
- Molecular formula
- C6H3N3O
- Molecular weight
- 133.11
Names & synonyms
4-formylpyrimidine-2-carbonitrile145276-04-62-PYRIMIDINECARBONITRILE, 4-FORMYL-2-Pyrimidinecarbonitrile, 4-formyl- (9CI)SCHEMBL9324408AB74054DB-282545
Database identifiers
- CAS
145276-04-6- PubChem CID
- 10240846
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 171
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Related reactions
1 records
Compound notes
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