| CAS Number | 1093416-63-7 |
| Catalog Number | AG01C498 |
| Chemical Name | 1-(3,5-dimethyl-1H-pyrazol-4-yl)propan-2-amine |
| IUPAC Name | 1-(3,5-dimethyl-1H-pyrazol-4-yl)propan-2-amine |
| InChI | InChI=1S/C8H15N3/c1-5(9)4-8-6(2)10-11-7(8)3/h5H,4,9H2,1-3H3,(H,10,11) |
| InChI Key | HDFBXEZJRWWBBA-UHFFFAOYSA-N |
| MDL Number | MFCD08700861 |
| Molecular Formula | C8H15N3 |
| Molecular Weight | 153.2248 |
| SMILES | CC(CC1=C(C)NN=C1C)N |
| Synonyms | 1-(3,5-dimethyl-1H-pyrazol-4-yl)propan-2-amine,
1093416-63-7,
AKOS017417428,
|
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.229g/mol |
| Monoisotopic Mass | 153.127g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number