| CAS Number | 1211587-69-7 |
| Catalog Number | AG019RZP(AGN-PC-0WO97S) |
| Chemical Name | 2-(1H-1,2,3,4-tetrazol-5-yl)propan-2-amine |
| IUPAC Name | 2-(2H-tetrazol-5-yl)propan-2-amine |
| InChI | InChI=1S/C4H9N5/c1-4(2,5)3-6-8-9-7-3/h5H2,1-2H3,(H,6,7,8,9) |
| InChI Key | LGOYTARNYBSMGN-UHFFFAOYSA-N |
| MDL Number | MFCD12796286 |
| Molecular Formula | C4H9N5 |
| Molecular Weight | 127.1478 |
| SMILES | CC(C1NN=NN=1)(N)C |
| Synonyms | 2-(1H-1,2,3,4-tetrazol-5-yl)propan-2-amine,
2-(2H-tetrazol-5-yl)propan-2-amine,
1211587-69-7,
SCHEMBL1516243,
ZINC40397103,
AKOS010395056,
NE49476,
EN300-91243,
|
| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 127.086g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 127.151g/mol |
| Monoisotopic Mass | 127.086g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 80.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1 |
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Certificate of Analysis
Lot Number