Basic information
- CAS
89488-03-9- Standard SMILES
O=c1[nH]cnc2[nH]c(O)cc12- InChIKey
NPSRPZYORWQURE-UHFFFAOYSA-N- Molecular formula
- C6H5N3O2
- Average molar mass
- 151.12 g/mol
- Monoisotopic mass
- 151.03817641
Names & identifiers
- Preferred name
- 7H-Pyrrolo[2,3-D]pyrimidine-4,6-diol
- IUPAC
- 6-hydroxy-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
Names & synonyms
7H-PYRROLO[2,3-D]PYRIMIDINE-4,6-DIOL89488-03-9DTXSID90723211DB-3337496-Hydroxy-1,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Database identifiers
- CAS
89488-03-9- PubChem CID
- 136257596
- DTXSID
DTXSID90723211
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 77.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 216
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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