| CAS Number | 1250037-05-8 |
| Catalog Number | AG01BFZV |
| Chemical Name | 3-(furan-2-yl)-1-(propan-2-yl)-1H-pyrazol-5-amine |
| IUPAC Name | 5-(furan-2-yl)-2-propan-2-ylpyrazol-3-amine |
| InChI | InChI=1S/C10H13N3O/c1-7(2)13-10(11)6-8(12-13)9-4-3-5-14-9/h3-7H,11H2,1-2H3 |
| InChI Key | LTPYTJHCFJRFBN-UHFFFAOYSA-N |
| MDL Number | MFCD14609304 |
| Molecular Formula | C10H13N3O |
| Molecular Weight | 191.2297 |
| SMILES | CC(N1C(N)=CC(C2OC=CC=2)=N1)C |
| Synonyms | 3-(furan-2-yl)-1-(propan-2-yl)-1H-pyrazol-5-amine,
1250037-05-8,
ZINC40926718,
AKOS010515744,
NE20708,
Z1945695969,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.234g/mol |
| Monoisotopic Mass | 191.106g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number