| CAS Number | 1376333-10-6 |
| Catalog Number | AG019TCV(AGN-PC-0WO33E) |
| Chemical Name | 4-bromo-3-ethyl-1H-pyrazol-5-amine |
| IUPAC Name | 4-bromo-5-ethyl-1H-pyrazol-3-amine |
| InChI | InChI=1S/C5H8BrN3/c1-2-3-4(6)5(7)9-8-3/h2H2,1H3,(H3,7,8,9) |
| InChI Key | KHUIFIOOCHXSNS-UHFFFAOYSA-N |
| MDL Number | MFCD08669406 |
| Molecular Formula | C5H8BrN3 |
| Molecular Weight | 190.0411 |
| SMILES | CCC1C(Br)=C(N)NN=1 |
| Synonyms | 4-Bromo-3-ethyl-1H-pyrazol-5-amine,
1376333-10-6,
ZINC72266441,
4-bromo-5-ethyl-1H-pyrazol-3-amine,
AKOS006291013,
AKOS023560075,
NE42000,
AJ-120901,
Z1318147484,
|
| Complexity | 98.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.044g/mol |
| Monoisotopic Mass | 188.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number