6-Hydroxy-5-methanimidoyl-1-propylpyrimidine-2,4-dione
Basic information
- CAS
69998-16-9- Standard SMILES
CCCn1c(O)c(C=N)c(=O)[nH]c1=O- InChIKey
NQFJUJMGIZPVII-UHFFFAOYSA-N- Molecular formula
- C8H11N3O3
- Average molar mass
- 197.19 g/mol
- Monoisotopic mass
- 197.08004122
Names & identifiers
- Preferred name
- 6-Hydroxy-5-methanimidoyl-1-propylpyrimidine-2,4-dione
- IUPAC
- 6-hydroxy-5-methanimidoyl-1-propylpyrimidine-2,4-dione
Names & synonyms
NSC149051NSC-149051
Database identifiers
- CAS
69998-16-9- PubChem CID
- 288287
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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