| CAS Number | 1268334-99-1 |
| Catalog Number | AG000TAZ(AGN-PC-09HXFF) |
| Chemical Name | 1H-Pyrazole, 5-bromo-1-ethyl- |
| IUPAC Name | 5-bromo-1-ethylpyrazole |
| InChI | InChI=1S/C5H7BrN2/c1-2-8-5(6)3-4-7-8/h3-4H,2H2,1H3 |
| InChI Key | GHCZXPXCEJYMOF-UHFFFAOYSA-N |
| MDL Number | MFCD18447684 |
| Molecular Formula | C5H7BrN2 |
| Molecular Weight | 175.0265 |
| SMILES | CCN1N=CC=C1Br |
| Synonyms | 5-Bromo-1-ethyl-1H-pyrazole,
1268334-99-1,
1H-pyrazole, 5-bromo-1-ethyl-,
1-ethyl-5-bromopyrazole,
DTXSID50680497,
ALBB-028849,
5279AA,
MFCD18447684,
ZINC59270635,
AKOS006315862,
AJ-113428,
Y-7953,
C5H7BrN2,
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| Complexity | 76.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.029g/mol |
| Monoisotopic Mass | 173.979g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number