Basic information
- CAS
64102-60-9- Standard SMILES
Nc1cn2ncnc2c(=O)[nH]1- InChIKey
DXFACOSFRFFEQI-UHFFFAOYSA-N- Molecular formula
- C5H5N5O
- Average molar mass
- 151.13 g/mol
- Monoisotopic mass
- 151.0494098
Names & identifiers
- Preferred name
- 6-Amino(1,2,4)triazolo(1,5-a)pyrazin-8(7H)-one
- IUPAC
- 6-amino-7H-[1,2,4]triazolo[1,5-a]pyrazin-8-one
- English name
- [1,2,4]Triazolo[1,5-a]pyrazin-8(7H)-one,6-amino-(9CI)
- Molecular formula
- C5H5N5O
- Molecular weight
- 151.13
Names & synonyms
64102-60-96-Amino(1,2,4)triazolo(1,5-a)pyrazin-8(7H)-oneKN7IMK4MF7UNII-KN7IMK4MF7NSC 344521NSC-344521DTXSID302143106-Amino[1,2,4]triazolo[1,5-a]pyrazin-8(7H)-one(1,2,4)TRIAZOLO(1,5-A)PYRAZIN-8(7H)-ONE, 6-AMINO-[1,2,4]Triazolo[1,5-a]pyrazin-8(7H)-one, 6-amino-RefChem:104155DTXCID30136801
Show more names
[1,2,4]Triazolo[1,5-a]pyrazin-8(7H)-one,6-amino-(9CI)
NSC3445216-amino-7H-[1,2,4]triazolo[1,5-a]pyrazin-8-one6-amino-[1,2,4]triazolo[1,5-a]pyrazin-8(7H)-oneSCHEMBL20400159DB-322252
Database identifiers
- CAS
64102-60-9- PubChem CID
- 335409
- DTXSID
DTXSID30214310- UNII
- KN7IMK4MF7
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 85.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Melting point
- 300 °C · 300 °C
- Density
- 2.01 · 2.01±0.1 g/cm3(Predicted)
- pka
- 8.34 · 8.34±0.40(Predicted)
- FDA UNII
- 7 IMK4MF7 · KN7IMK4MF7
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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