| CAS Number | 1158049-15-0 |
| Catalog Number | AG01AATU(AGN-PC-0WO5MT) |
| Chemical Name | [1-methyl-3-(propan-2-yl)-1H-pyrazol-4-yl]methanamine |
| IUPAC Name | (1-methyl-3-propan-2-ylpyrazol-4-yl)methanamine |
| InChI | InChI=1S/C8H15N3/c1-6(2)8-7(4-9)5-11(3)10-8/h5-6H,4,9H2,1-3H3 |
| InChI Key | QXAWBMLPFWBBNE-UHFFFAOYSA-N |
| MDL Number | MFCD11858228 |
| Molecular Formula | C8H15N3 |
| Molecular Weight | 153.2248 |
| SMILES | CC(C1C(CN)=CN(C)N=1)C |
| Synonyms | [1-methyl-3-(propan-2-yl)-1H-pyrazol-4-yl]methanamine,
1158049-15-0,
AC1Q1OY0,
CTK7E6803,
ZINC32625287,
AKOS009939989,
MCULE-4107187709,
NE57442,
EN300-69552,
Z1263811690,
(3-ISOPROPYL-1-METHYL-1H-PYRAZOL-4-YL)METHYLAMINE,
|
| 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 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number