| CAS Number | 1211589-69-3 |
| Catalog Number | AG009YD5 |
| Chemical Name | 4-(difluoromethyl)-1H-pyrazole |
| IUPAC Name | 4-(difluoromethyl)-1H-pyrazole |
| InChI | InChI=1S/C4H4F2N2/c5-4(6)3-1-7-8-2-3/h1-2,4H,(H,7,8) |
| InChI Key | DVFOWRRDDWWJRU-UHFFFAOYSA-N |
| MDL Number | MFCD29760982 |
| Molecular Formula | C4H4F2N2 |
| Molecular Weight | 118.0848 |
| SMILES | FC(C=1C=NNC1)F |
| Synonyms | 4-(difluoromethyl)-1H-pyrazole,
1211589-69-3,
MFCD29760982,
SCHEMBL8593149,
AKOS030623262,
ZINC204540547,
FCH4729917,
AX8279532,
F2147-6838,
1-2 weeks,
|
| Complexity | 76.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 118.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 118.087g/mol |
| Monoisotopic Mass | 118.034g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number