| CAS Number | 1006481-44-2 |
| Catalog Number | AG00JEV5(AGN-PC-0WBAM9) |
| Chemical Name | 4-bromo-1-ethyl-1H-pyrazol-3-amine |
| IUPAC Name | 4-bromo-1-ethylpyrazol-3-amine |
| InChI | InChI=1S/C5H8BrN3/c1-2-9-3-4(6)5(7)8-9/h3H,2H2,1H3,(H2,7,8) |
| InChI Key | NCESDSGUTSIAKE-UHFFFAOYSA-N |
| MDL Number | MFCD06805176 |
| Molecular Formula | C5H8BrN3 |
| Molecular Weight | 190.0411 |
| SMILES | NC1=NN(CC)C=C1Br |
| Synonyms | 4-bromo-1-ethyl-1H-pyrazol-3-amine,
1006481-44-2,
4-bromo-1-ethylpyrazole-3-ylamine,
CTK6E9621,
MFCD06805176,
SBB022909,
STK510080,
ZINC20313640,
AKOS000308980,
MCULE-4008780791,
ST45054976,
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| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.044g/mol |
| Monoisotopic Mass | 188.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number