| CAS Number | 1374651-37-2 |
| Catalog Number | AG009XUN |
| Chemical Name | Ammonium 5-(5-bromopyridin-2-yl)tetrazol-2-ide |
| IUPAC Name | azane;5-bromo-2-(2H-tetrazol-5-yl)pyridine |
| InChI | InChI=1S/C6H4BrN5.H3N/c7-4-1-2-5(8-3-4)6-9-11-12-10-6;/h1-3H,(H,9,10,11,12);1H3 |
| InChI Key | VIKBGUZHGSNIJC-UHFFFAOYSA-N |
| MDL Number | MFCD22377973 |
| Molecular Formula | C6H7BrN6 |
| Molecular Weight | 243.0640 |
| SMILES | [NH4+].BrC1=CN=C(C=C1)C1=N[N-]N=N1 |
| Synonyms | 5-BROMO-2-(2H-TETRAZOL-5-YL)PYRIDINE AMMONIA SALT,
1374651-37-2,
MFCD22377973,
CS-13918,
Bromo-2-(2h-tetrazol-5-yl)pyridine ammonia salt,
5-BROMO-2-(2H-TETRAZOL-5-YL)PYRIDINEAMMONIASALT,
azane,
5-Bromo-2-(1H-tetrazol-5-yl)pyridine,
5-bromo-2-(2H-tetrazol-5-yl)pyridine,
380380-60-9,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.992g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.068g/mol |
| Monoisotopic Mass | 241.992g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 68.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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