2,6-Dihydroxy-3-methyl-3,4-dihydropyrimidin-4-one
Basic information
- CAS
882872-13-1- Standard SMILES
Cn1c(O)cc(=O)[nH]c1=O- InChIKey
HUMSUAIRAJXARC-UHFFFAOYSA-N- Molecular formula
- C5H6N2O3
- Average molar mass
- 142.11 g/mol
- Monoisotopic mass
- 142.03784206
Names & identifiers
- Preferred name
- 2,6-Dihydroxy-3-methyl-3,4-dihydropyrimidin-4-one
- IUPAC
- 6-hydroxy-1-methylpyrimidine-2,4-dione
- English name
- 6-hydroxy-3-methylpyrimidine-2,4(1H,3H)-dione
- Molecular formula
- C5H6N2O3
- Molecular weight
- 142.11274
Names & synonyms
2,6-dihydroxy-3-methyl-3,4-dihydropyrimidin-4-one882872-13-1DTXSID00353023RefChem:248401DTXCID103040866-hydroxy-1-methylpyrimidine-2,4-dione6-hydroxy-3-methylpyrimidine-2,4(1H,3H)-dioneSCHEMBL124328336-hydroxy-3-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dioneAKOS006230695AKOS0168453096-hydroxy-1-methylpyrimidine-2,4(1H,3H)-dione
Show more names
AN-970/40920492pyrimidine-2,4(1H,3H)-dione, 6-hydroxy-1-methyl-F8885-3228
Database identifiers
- CAS
882872-13-1- PubChem CID
- 736435
- DTXSID
DTXSID00353023- Nikkaji
- J1.957.641H、J2.710.465G
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 221
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Compound notes
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