| CAS Number | 15001-15-7 |
| Catalog Number | AG01AAIG(AGN-PC-0WO9QK) |
| Chemical Name | 1-(3-chlorophenyl)-1H-pyrazol-5-amine |
| IUPAC Name | 2-(3-chlorophenyl)pyrazol-3-amine |
| InChI | InChI=1S/C9H8ClN3/c10-7-2-1-3-8(6-7)13-9(11)4-5-12-13/h1-6H,11H2 |
| InChI Key | QRYREVLPUANDIV-UHFFFAOYSA-N |
| MDL Number | MFCD11641447 |
| Molecular Formula | C9H8ClN3 |
| Molecular Weight | 193.6329 |
| SMILES | NC1N(C2=CC(Cl)=CC=C2)N=CC=1 |
| Synonyms | 1-(3-chlorophenyl)-1H-pyrazol-5-amine,
15001-15-7,
2-(3-Chlorophenyl)-2H-pyrazol-3-ylamine,
AC1Q52BV,
SCHEMBL544287,
ZINC37245401,
AKOS008129048,
KS-6973,
MCULE-6345238564,
NE28602,
EN300-68701,
Z1263602460,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.634g/mol |
| Monoisotopic Mass | 193.041g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number