1,2,5-Triaminopyrrole-3,4-dicarbonitrile
Basic information
- CAS
75610-90-1- Standard SMILES
N#Cc1c(C#N)c(N)n(N)c1N- InChIKey
QLOQIWYZKJKMSR-UHFFFAOYSA-N- Molecular formula
- C6H6N6
- Average molar mass
- 162.15 g/mol
- Monoisotopic mass
- 162.06539422
Names & identifiers
- Preferred name
- 1,2,5-Triaminopyrrole-3,4-dicarbonitrile
- IUPAC
- 1,2,5-triaminopyrrole-3,4-dicarbonitrile
Names & synonyms
1,2,5-triaminopyrrole-3,4-dicarbonitrile75610-90-1DTXSID90308163RefChem:215374DTXCID202592901,2,5-Triamino-1H-pyrrole-3,4-dicarbonitrileNSC202588QLOQIWYZKJKMSR-UHFFFAOYSA-N1,2,5-triamino-3,4-dicyanopyrroleSTK842573AKOS001744051NSC-202588
Show more names
ST037266SR-01000529901SR-01000529901-1
Database identifiers
- CAS
75610-90-1- PubChem CID
- 305571
- DTXSID
DTXSID90308163
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 240
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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