| CAS Number | 880488-27-7 |
| Catalog Number | AG01A4GU(AGN-PC-07AUBB) |
| Chemical Name | 1-(Tert-butyl)-5-methyl-1h-pyrazol-3-amine |
| IUPAC Name | 1-tert-butyl-5-methylpyrazol-3-amine |
| InChI | InChI=1S/C8H15N3/c1-6-5-7(9)10-11(6)8(2,3)4/h5H,1-4H3,(H2,9,10) |
| InChI Key | LBQKIARPNRNHHQ-UHFFFAOYSA-N |
| MDL Number | MFCD16845342 |
| Molecular Formula | C8H15N3 |
| Molecular Weight | 153.2248 |
| SMILES | NC1=NN(C(C)(C)C)C(C)=C1 |
| Synonyms | 880488-27-7,
1-tert-butyl-5-methyl-1H-pyrazol-3-amine,
1-(tert-Butyl)-5-methyl-1H-pyrazol-3-amine,
SCHEMBL902037,
LBQKIARPNRNHHQ-UHFFFAOYSA-N,
ZINC39133723,
AKOS011973671,
NE55467,
1-tert-butyl-5-methyl-1H-pyrazol-3-ylamine,
1H-Pyrazol-3-amine,1- -5-methyl-,
1H-Pyrazol-3-amine, 1-(1,1-dimethylethyl)-5-methyl-,
|
| Complexity | 139 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.229g/mol |
| Monoisotopic Mass | 153.127g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number