| CAS Number | 926191-56-2 |
| Catalog Number | AG019LB1(AGN-PC-0WO7A6) |
| Chemical Name | 3-hydrazinyl-4-methyl-5-phenyl-4H-1,2,4-triazole |
| IUPAC Name | (4-methyl-5-phenyl-1,2,4-triazol-3-yl)hydrazine |
| InChI | InChI=1S/C9H11N5/c1-14-8(12-13-9(14)11-10)7-5-3-2-4-6-7/h2-6H,10H2,1H3,(H,11,13) |
| InChI Key | PTICRJHPJJHINP-UHFFFAOYSA-N |
| MDL Number | MFCD06660925 |
| Molecular Formula | C9H11N5 |
| Molecular Weight | 189.2171 |
| SMILES | CN1C(C2=CC=CC=C2)=NN=C1NN |
| Synonyms | 3-hydrazinyl-4-methyl-5-phenyl-4H-1,2,4-triazole,
3-hydrazino-4-methyl-5-phenyl-4H-1,2,4-triazole,
926191-56-2,
AC1Q3Y54,
CTK7F1880,
ZINC20281529,
AKOS000123429,
NE34811,
EN300-30652,
|
| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.222g/mol |
| Monoisotopic Mass | 189.101g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
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Certificate of Analysis
Lot Number