| CAS Number | 3524-36-5 |
| Catalog Number | AG007EVJ(AGN-PC-0WB3KR) |
| Chemical Name | 1-Isobutyl-3-methyl-1H-pyrazol-5-amine |
| IUPAC Name | 5-methyl-2-(2-methylpropyl)pyrazol-3-amine |
| InChI | InChI=1S/C8H15N3/c1-6(2)5-11-8(9)4-7(3)10-11/h4,6H,5,9H2,1-3H3 |
| InChI Key | IWIDVCGRTHJZHX-UHFFFAOYSA-N |
| MDL Number | MFCD06805200 |
| Molecular Formula | C8H15N3 |
| Molecular Weight | 153.2248 |
| SMILES | N1(CC(C)C)N=C(C=C1N)C |
| Synonyms | 1-ISOBUTYL-3-METHYL-1H-PYRAZOL-5-AMINE,
3524-36-5,
3-methyl-1-(2-methylpropyl)-1H-pyrazol-5-amine,
SCHEMBL11128959,
CTK4H4016,
DTXSID90599115,
MFCD06805200,
STL414488,
ZINC19090085,
AKOS000308970,
MCULE-4850174714,
AJ-71338,
DB-029183,
FT-0703888,
Y-2627,
1-Isobutyl-3-methyl-1H-pyrazol-5-amine, AldrichCPR,
|
| Complexity | 125 |
| 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 | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number