Basic information
- CAS
109831-69-8- Standard SMILES
Nc1ncnc(N)c1C=NO- InChIKey
BZFIGHILKMPLOG-UHFFFAOYSA-N- Molecular formula
- C5H7N5O
- Average molar mass
- 153.14 g/mol
- Monoisotopic mass
- 153.06505986
Names & identifiers
- Preferred name
- N-[(4,6-diaminopyrimidin-5-yl)methylidene]hydroxylamine
- IUPAC
- N-[(4,6-diaminopyrimidin-5-yl)methylidene]hydroxylamine
Names & synonyms
4,6-Diamino-5-pyrimidinecarboxaldehyde oximeSCHEMBL1094886N-[(4,6-diaminopyrimidin-5-yl)methylidene]hydroxylamineDTXSID801258153109831-69-8
Database identifiers
- CAS
109831-69-8- PubChem CID
- 258151
- DTXSID
DTXSID801258153
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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