| CAS Number | 1172325-06-2 |
| Catalog Number | AG008V5M(AGN-PC-0WB5AY) |
| Chemical Name | 4-(4-amino-1H-pyrazol-1-yl)butanamide |
| IUPAC Name | 4-(4-aminopyrazol-1-yl)butanamide |
| InChI | InChI=1S/C7H12N4O/c8-6-4-10-11(5-6)3-1-2-7(9)12/h4-5H,1-3,8H2,(H2,9,12) |
| InChI Key | FXEANMJANRFKGT-UHFFFAOYSA-N |
| MDL Number | MFCD12028401 |
| Molecular Formula | C7H12N4O |
| Molecular Weight | 168.1964 |
| SMILES | N1=CC(=CN1CCCC(N)=O)N |
| Synonyms | 4-(4-amino-1H-pyrazol-1-yl)butanamide,
1172325-06-2,
CTK7D3196,
DTXSID30649340,
4-(4-aminopyrazol-1-yl)butanamide,
ALBB-009827,
ZX-AN008684,
ZX-CM007519,
9901AC,
MFCD12028401,
STK506090,
ZINC33414624,
1H-pyrazole-1-butanamide, 4-amino-,
AKOS005172444,
MCULE-2780853543,
RTR-061434,
AJ-85986,
TR-061434,
Y-7004,
C7H12N4O,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.101g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.2g/mol |
| Monoisotopic Mass | 168.101g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 86.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number