Basic information
- CAS
4030-02-8- Standard SMILES
Cc1nc(N)n(O)c(=N)n1- InChIKey
VDKHVIHAGIOBGV-UHFFFAOYSA-N- Molecular formula
- C4H7N5O
- Average molar mass
- 141.13 g/mol
- Monoisotopic mass
- 141.06505986
Names & identifiers
- Preferred name
- 1-Hydroxy-6-imino-4-methyl-1,3,5-triazin-2-amine
- IUPAC
- 1-hydroxy-6-imino-4-methyl-1,3,5-triazin-2-amine
Names & synonyms
1-hydroxy-6-imino-4-methyl-1,3,5-triazin-2-amine4030-02-8DTXSID50274653RefChem:230890DTXCID902261166-Amino-2-imino-4-methyl-1,3,5-triazin-1(2H)-ol(6-amino-4-methyl-1-oxido-[1,3,5]triazin-1-ium-2-yl)-amine
Database identifiers
- CAS
4030-02-8- PubChem CID
- 19942
- DTXSID
DTXSID50274653- Nikkaji
- J1.553.697G
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 98.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 230
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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