| CAS Number | 1185767-06-9 |
| Catalog Number | AG0091SY(AGN-PC-0WNGSW) |
| Chemical Name | 5-Bromo-6-fluoro-1-methyl-1H-indazole |
| IUPAC Name | 5-bromo-6-fluoro-1-methylindazole |
| InChI | InChI=1S/C8H6BrFN2/c1-12-8-3-7(10)6(9)2-5(8)4-11-12/h2-4H,1H3 |
| InChI Key | LILHEKOPCWVHAA-UHFFFAOYSA-N |
| MDL Number | MFCD18906723 |
| Molecular Formula | C8H6BrFN2 |
| Molecular Weight | 229.0490 |
| SMILES | CN1N=CC2=C1C=C(F)C(Br)=C2 |
| Synonyms | 5-bromo-6-fluoro-1-methyl-1H-indazole,
1185767-06-9,
1H-Indazole,5-bromo-6-fluoro-1-methyl-,
SCHEMBL1191266,
LILHEKOPCWVHAA-UHFFFAOYSA-N,
KS-000005JK,
MFCD18906723,
ZINC82349683,
FCH1347567,
AS-48473,
PC500259,
CS-0050577,
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| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.052g/mol |
| Monoisotopic Mass | 227.97g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number