| CAS Number | 1033780-34-5 |
| Catalog Number | AG01A8E9(AGN-PC-0WO2TI) |
| Chemical Name | 1-(pyridin-3-ylmethyl)-1H-pyrazol-3-amine |
| IUPAC Name | 1-(pyridin-3-ylmethyl)pyrazol-3-amine |
| InChI | InChI=1S/C9H10N4/c10-9-3-5-13(12-9)7-8-2-1-4-11-6-8/h1-6H,7H2,(H2,10,12) |
| InChI Key | YYCRJGNJFWCGAL-UHFFFAOYSA-N |
| MDL Number | MFCD12149379 |
| Molecular Formula | C9H10N4 |
| Molecular Weight | 174.2025 |
| SMILES | NC1=NN(CC2=CN=CC=C2)C=C1 |
| Synonyms | 1-(pyridin-3-ylmethyl)-1H-pyrazol-3-amine,
1033780-34-5,
SCHEMBL944098,
AC1Q532H,
CTK7E0176,
YYCRJGNJFWCGAL-UHFFFAOYSA-N,
ZINC37418674,
AKOS009998355,
NE58351,
DA-16104,
1-pyridin-3-ylmethyl-1H-pyrazol-3-ylamine,
FT-0724255,
1-Pyridine-3-ylmethyl-1H-pyrazole-3-ylamine,
EN300-61418,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.207g/mol |
| Monoisotopic Mass | 174.091g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 56.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number