| CAS Number | 926241-20-5 |
| Catalog Number | AG019V87(AGN-PC-0WOA31) |
| Chemical Name | 5-chloro-2-(1H-pyrazol-1-yl)aniline |
| IUPAC Name | 5-chloro-2-pyrazol-1-ylaniline |
| InChI | InChI=1S/C9H8ClN3/c10-7-2-3-9(8(11)6-7)13-5-1-4-12-13/h1-6H,11H2 |
| InChI Key | WNBYMUJXCDBWTJ-UHFFFAOYSA-N |
| MDL Number | MFCD08696902 |
| Molecular Formula | C9H8ClN3 |
| Molecular Weight | 193.6329 |
| SMILES | NC1=C(N2N=CC=C2)C=CC(Cl)=C1 |
| Synonyms | 5-chloro-2-(1H-pyrazol-1-yl)aniline,
926241-20-5,
5-chloro-2-pyrazolylphenylamine,
AC1Q50TG,
CTK6G8418,
SBB073297,
STL414819,
ZINC20353602,
AKOS000133357,
MCULE-7788175496,
NE29738,
ST51061564,
EN300-44052,
Z451350678,
|
| 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 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number