| CAS Number | 1184645-19-9 |
| Catalog Number | AG01A2SG(AGN-PC-0WO1LV) |
| Chemical Name | 2,5-diaminopyridine-3-carbonitrile |
| IUPAC Name | 2,5-diaminopyridine-3-carbonitrile |
| InChI | InChI=1S/C6H6N4/c7-2-4-1-5(8)3-10-6(4)9/h1,3H,8H2,(H2,9,10) |
| InChI Key | GKMXOWBTHCYDGI-UHFFFAOYSA-N |
| MDL Number | MFCD12768824 |
| Molecular Formula | C6H6N4 |
| Molecular Weight | 134.1386 |
| SMILES | NC1=CC(C#N)=C(N)N=C1 |
| Synonyms | 2,5-Diaminonicotinonitrile,
2,5-diaminopyridine-3-carbonitrile,
1184645-19-9,
SCHEMBL7898980,
ZINC37759030,
AKOS010146015,
NE57527,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 134.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 134.142g/mol |
| Monoisotopic Mass | 134.059g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 88.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
Lot Number