| CAS Number | 1286734-93-7 |
| Catalog Number | AG000YA2(AGN-PC-09SH5V) |
| Chemical Name | 6-Bromo-3-chloro-5-fluoro-1-methyl-1H-indazole |
| IUPAC Name | 6-bromo-3-chloro-5-fluoro-1-methylindazole |
| InChI | InChI=1S/C8H5BrClFN2/c1-13-7-3-5(9)6(11)2-4(7)8(10)12-13/h2-3H,1H3 |
| InChI Key | AIKQPKXPTSVBRM-UHFFFAOYSA-N |
| MDL Number | MFCD18384876 |
| Molecular Formula | C8H5BrClFN2 |
| Molecular Weight | 263.4941 |
| SMILES | BrC1=C(C=C2C(=NN(C2=C1)C)Cl)F |
| Synonyms | 6-Bromo-3-chloro-5-fluoro-1-methyl-1H-indazole,
1286734-93-7,
6-bromo-3-chloro-5-fluoro-1-methylindazole,
KS-00003R1Y,
ZX-AP001251,
MFCD18384876,
ZINC71790130,
AKOS026675581,
FCH1368583,
PC51024,
PS-7347,
K-4004,
1H-Indazole, 6-bromo-3-chloro-5-fluoro-1-methyl-,
6-bromo-3-chloro-5-fluoro-1-methyl-1H-indazole, 95% - 1G 1g,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.931g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.494g/mol |
| Monoisotopic Mass | 261.931g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number