| CAS Number | 1019010-72-0 |
| Catalog Number | AG01BF3R |
| Chemical Name | 3-(3,5-Difluorophenyl)-1-methyl-1H-pyrazol-5-amine |
| IUPAC Name | 5-(3,5-difluorophenyl)-2-methylpyrazol-3-amine |
| InChI | InChI=1S/C10H9F2N3/c1-15-10(13)5-9(14-15)6-2-7(11)4-8(12)3-6/h2-5H,13H2,1H3 |
| InChI Key | KSTRVVMIEWSJBB-UHFFFAOYSA-N |
| MDL Number | MFCD05664775 |
| Molecular Formula | C10H9F2N3 |
| Molecular Weight | 209.1954 |
| SMILES | CN1C(N)=CC(C2=CC(F)=CC(F)=C2)=N1 |
| Synonyms | 3-(3,5-difluorophenyl)-1-methyl-1H-pyrazol-5-amine,
1019010-72-0,
1H-Pyrazol-5-amine, 3-(3,5-difluorophenyl)-1-methyl-,
SCHEMBL15813696,
ZINC2548556,
AKOS009335002,
NE25952,
Z1889706343,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.2g/mol |
| Monoisotopic Mass | 209.076g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number