Basic information
- Standard SMILES
C=CCc1c(O)nc[nH]c1=O- InChIKey
QWYRCXSPNDGEAQ-UHFFFAOYSA-N- Molecular formula
- C7H8N2O2
- Average molar mass
- 152.15 g/mol
Names & identifiers
- Preferred name
- 5-Allylpyrimidine-4,6-diol
- IUPAC
- 4-hydroxy-5-prop-2-enyl-1H-pyrimidin-6-one
Names & synonyms
5-allylpyrimidine-4,6-diol16019-30-04-hydroxy-5-prop-2-enyl-1H-pyrimidin-6-one4(3H)-Pyrimidinone, 6-hydroxy-5-(2-propen-1-yl)-MFCD13192751MFCD1701940323903-65-35-allylpyrimidine-4,6(1H,5H)-dione5-Allyl-4-hydroxy-1H-pyrimidin-6-one5-allyl-6-hydroxy-1H-pyrimidin-4-one6-hydroxy-5-(prop-2-en-1-yl)-3,4-dihydropyrimidin-4-one5-allyl-pyrimidine-4,6-diol
Show more names
4,6-Pyrimidinediol, 5-allyl- (8CI); 5-Allyl-6-hydroxy-3H-pyrimidin-4-one; 5-Allylpyrimidine-4,6-diol; 6-Hydroxy-5-(2-propen-1-yl)-4(1H)-pyrimidinone5-ALLYL-6-HYDROXYPYRIMIDIN-4(3H)-ONESCHEMBL2059464SCHEMBL3939185SCHEMBL129852205-allyl-4,6-dihydroxypyrimidineQWYRCXSPNDGEAQ-UHFFFAOYSA-NCS-M2479
Database identifiers
- PubChem CID
- 25421575
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 253
Related reactions
1 records
Linked notes
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