| CAS Number | 1006453-84-4 |
| Catalog Number | AG01BDK5(AGN-PC-0WOVF1) |
| Chemical Name | 1-(Butan-2-yl)-5-methyl-1H-pyrazol-4-amine |
| IUPAC Name | 1-butan-2-yl-5-methylpyrazol-4-amine |
| InChI | InChI=1S/C8H15N3/c1-4-6(2)11-7(3)8(9)5-10-11/h5-6H,4,9H2,1-3H3 |
| InChI Key | UUCDZQKDWWDXRH-UHFFFAOYSA-N |
| MDL Number | MFCD06805449 |
| Molecular Formula | C8H15N3 |
| Molecular Weight | 153.2248 |
| SMILES | CCC(N1C(C)=C(N)C=N1)C |
| Synonyms | 1-(butan-2-yl)-5-methyl-1H-pyrazol-4-amine,
1006453-84-4,
CTK6C9094,
AKOS000309402,
MCULE-1477031962,
NE26739,
1-SEC-BUTYL-5-METHYL-1H-PYRAZOL-4-AMINE,
Z1874954907,
1H-Pyrazol-4-amine, 5-methyl-1-(1-methylpropyl)-,
|
| Complexity | 127 |
| 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 | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number