| CAS Number | 150187-16-9 |
| Catalog Number | AG01AONZ(AGN-PC-02KBAE) |
| Chemical Name | 4-Iodo-1-methyl-1H-pyrazol-3-amine |
| IUPAC Name | 4-iodo-1-methylpyrazol-3-amine |
| InChI | InChI=1S/C4H6IN3/c1-8-2-3(5)4(6)7-8/h2H,1H3,(H2,6,7) |
| InChI Key | JBQVNSOBIFKMSX-UHFFFAOYSA-N |
| MDL Number | MFCD00847646 |
| Molecular Formula | C4H6IN3 |
| Molecular Weight | 223.0150 |
| SMILES | CN1N=C(N)C(I)=C1 |
| Synonyms | 4-iodo-1-methyl-1H-pyrazol-3-amine,
150187-16-9,
SCHEMBL8556012,
4-iodo-1-methylpyrazole-3-ylamine,
MFCD00847646,
SBB074169,
STL415155,
ZINC72339436,
AKOS015920984,
MCULE-8587087808,
Z2106604813,
|
| Complexity | 87.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.961g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.017g/mol |
| Monoisotopic Mass | 222.961g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number