| CAS Number | 166588-10-9 |
| Catalog Number | AG01DYT0 |
| Chemical Name | 1-(4-fluorophenyl)-3-methyl-1H-pyrazole |
| IUPAC Name | 1-(4-fluorophenyl)-3-methylpyrazole |
| InChI | InChI=1S/C10H9FN2/c1-8-6-7-13(12-8)10-4-2-9(11)3-5-10/h2-7H,1H3 |
| InChI Key | SIWQJXVMSFEFCO-UHFFFAOYSA-N |
| MDL Number | MFCD21668157 |
| Molecular Formula | C10H9FN2 |
| Molecular Weight | 176.1903 |
| SMILES | CC1=NN(C2=CC=C(F)C=C2)C=C1 |
| Synonyms | SCHEMBL5539090,
1-(4-fluorophenyl)-3-methylpyrazole,
AKOS015356684,
1-(4-fluorophenyl)-3-methyl-pyrazole,
1-(4-fluorophenyl)-3-methyl-1H-pyrazole,
A819619,
166588-10-9,
288251-65-0,
|
| Complexity | 166 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.194g/mol |
| Monoisotopic Mass | 176.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number