1-Ethyl-5-fluoro-1H-pyrazole - CAS 1392274-40-6
Catalog: |
BB052215 |
Product Name: |
1-Ethyl-5-fluoro-1H-pyrazole |
CAS: |
1392274-40-6 |
Synonyms: |
1-ethyl-5-fluoro-1H-pyrazole |
IUPAC Name: | 1-ethyl-5-fluoropyrazole |
Molecular Weight: | 114.12 |
Molecular Formula: | C5H7FN2 |
Canonical SMILES: | CCN1C(=CC=N1)F |
InChI: | InChI=1S/C5H7FN2/c1-2-8-5(6)3-4-7-8/h3-4H,2H2,1H3 |
InChI Key: | ZGKYVWVNZDQFCN-UHFFFAOYSA-N |
Complexity: | 76.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 114.05932639 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 114.05932639 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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