1-(2-Fluoro-ethyl)-5-methyl-1H-pyrazole - CAS 1443279-14-8
Catalog: |
BB052353 |
Product Name: |
1-(2-Fluoro-ethyl)-5-methyl-1H-pyrazole |
CAS: |
1443279-14-8 |
Synonyms: |
1-(2-fluoroethyl)-5-methyl-1H-pyrazole |
IUPAC Name: | 1-(2-fluoroethyl)-5-methylpyrazole |
Molecular Weight: | 128.15 |
Molecular Formula: | C6H9FN2 |
Canonical SMILES: | CC1=CC=NN1CCF |
InChI: | InChI=1S/C6H9FN2/c1-6-2-4-8-9(6)5-3-7/h2,4H,3,5H2,1H3 |
InChI Key: | NIPGQAQNIPHPCQ-UHFFFAOYSA-N |
Complexity: | 87.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 128.07497646 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 128.07497646 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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