| CAS Number | 1354224-47-7 |
| Catalog Number | AG00IM6W(AGN-PC-0WP0V2) |
| Chemical Name | 1,3-Dimethyl-6-nitro-1H-indazole |
| IUPAC Name | 1,3-dimethyl-6-nitroindazole |
| InChI | InChI=1S/C9H9N3O2/c1-6-8-4-3-7(12(13)14)5-9(8)11(2)10-6/h3-5H,1-2H3 |
| InChI Key | RUTULKJFQZYUDG-UHFFFAOYSA-N |
| MDL Number | MFCD19443367 |
| Molecular Formula | C9H9N3O2 |
| Molecular Weight | 191.1867 |
| SMILES | CN1N=C(C2=CC=C(C=C12)[N+](=O)[O-])C |
| Synonyms | 1,3-Dimethyl-6-nitro-1H-indazole,
1354224-47-7,
SCHEMBL3380500,
ZINC87493393,
CS-0014268,
Y5803,
C9H9N3O2,
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| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.19g/mol |
| Monoisotopic Mass | 191.069g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 63.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number