| CAS Number | 1248180-56-4 |
| Catalog Number | AG01A4ZU(AGN-PC-0WO2SH) |
| Chemical Name | 1-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-amine |
| IUPAC Name | 1-(3-chlorophenyl)-5-methylpyrazol-3-amine |
| InChI | InChI=1S/C10H10ClN3/c1-7-5-10(12)13-14(7)9-4-2-3-8(11)6-9/h2-6H,1H3,(H2,12,13) |
| InChI Key | SWIDUGSHKPXBPE-UHFFFAOYSA-N |
| MDL Number | MFCD16845345 |
| Molecular Formula | C10H10ClN3 |
| Molecular Weight | 207.6595 |
| SMILES | CC1N(C2=CC(Cl)=CC=C2)N=C(N)C=1 |
| Synonyms | 1-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-amine,
1248180-56-4,
SCHEMBL19086968,
ZINC54404735,
AKOS011973887,
NE37580,
|
| Complexity | 200 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.661g/mol |
| Monoisotopic Mass | 207.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number