| CAS Number | 1257535-07-1 |
| Catalog Number | AG009Z68(AGN-PC-093FL4) |
| Chemical Name | 4-Fluoro-3-iodo-1-methyl-1H-indazole |
| IUPAC Name | 4-fluoro-3-iodo-1-methylindazole |
| InChI | InChI=1S/C8H6FIN2/c1-12-6-4-2-3-5(9)7(6)8(10)11-12/h2-4H,1H3 |
| InChI Key | VJJOCBRDOMLELE-UHFFFAOYSA-N |
| MDL Number | MFCD12756570 |
| Molecular Formula | C8H6FIN2 |
| Molecular Weight | 276.0495 |
| SMILES | CN1C2=CC=CC(=C2C(=N1)I)F |
| Synonyms | 4-Fluoro-3-iodo-1-methyl-1H-indazole,
1257535-07-1,
4-fluoro-3-iodo-1-methylindazole,
MFCD12756570,
KS-00003R0W,
ZX-AP001510,
5614AH,
PC8066,
ZINC71790242,
AKOS025404237,
FCH1376275,
PS-7250,
K-1901,
J-005282,
C8H6FIN2,
4-fluoro-3-iodo-1-methyl-1H-indazole, 95% - 1G 1g,
|
| Complexity | 178 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.956g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.053g/mol |
| Monoisotopic Mass | 275.956g/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
Certificate of Analysis
Lot Number