| CAS Number | 1154731-75-5 |
| Catalog Number | AG01AAW8 |
| Chemical Name | 2-amino-N-[2-(1H-1,2,4-triazol-1-yl)phenyl]acetamide |
| IUPAC Name | 2-amino-N-[2-(1,2,4-triazol-1-yl)phenyl]acetamide |
| InChI | InChI=1S/C10H11N5O/c11-5-10(16)14-8-3-1-2-4-9(8)15-7-12-6-13-15/h1-4,6-7H,5,11H2,(H,14,16) |
| InChI Key | IJQAWZIXCJPWOE-UHFFFAOYSA-N |
| MDL Number | MFCD12126895 |
| Molecular Formula | C10H11N5O |
| Molecular Weight | 217.2272 |
| SMILES | NCC(NC1=C(N2N=CN=C2)C=CC=C1)=O |
| Synonyms | 2-amino-N-[2-(1H-1,2,4-triazol-1-yl)phenyl]acetamide,
1154731-75-5,
AC1Q53L0,
ZINC37027664,
AKOS009897185,
MCULE-6091415620,
NE62091,
EN300-69765,
Z1696823742,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.232g/mol |
| Monoisotopic Mass | 217.096g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 85.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number