| CAS Number | 1192263-90-3 |
| Catalog Number | AG00IT2F(AGN-PC-0WB0QK) |
| Chemical Name | 4-Chloro-1-methyl-7-nitro-1H-indazol-3-amine |
| IUPAC Name | 4-chloro-1-methyl-7-nitroindazol-3-amine |
| InChI | InChI=1S/C8H7ClN4O2/c1-12-7-5(13(14)15)3-2-4(9)6(7)8(10)11-12/h2-3H,1H3,(H2,10,11) |
| InChI Key | XQIZZXZPBIMBGY-UHFFFAOYSA-N |
| MDL Number | MFCD13193092 |
| Molecular Formula | C8H7ClN4O2 |
| Molecular Weight | 226.6198 |
| SMILES | Cn1c2c(ccc(c2c(n1)N)Cl)N(=O)=O |
| Synonyms | 4-chloro-1-methyl-7-nitro-1H-indazol-3-amine,
1192263-90-3,
chloromethylnitroindazolamine,
CTK5I3038,
KS-00001Q9C,
MFCD13193092,
SBB097028,
ZINC40564692,
AKOS005073335,
LD-0711,
MCULE-4157078044,
RP13056,
4-chloro-1-methyl-7-nitroindazol-3-amine,
AJ-103510,
TR-065670,
4-chloro-1-methyl-7-nitro-1H-indazole-3-ylamine,
|
| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.62g/mol |
| Monoisotopic Mass | 226.026g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 89.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number