1-(4-fluorophenyl)pyrazole - CAS 81329-32-0
Catalog: |
BB072992 |
Product Name: |
1-(4-fluorophenyl)pyrazole |
CAS: |
81329-32-0 |
Synonyms: |
1-(4-FLUOROPHENYL)PYRAZOLE; 1-(4-fluorophenyl)-1H-pyrazole; 1H-Pyrazole, 1-(4-fluorophenyl)- |
IUPAC Name: | 1-(4-fluorophenyl)pyrazole |
Description: | 1-(4-fluorophenyl)pyrazole |
Molecular Weight: | 162.16 |
Molecular Formula: | C9H7FN2 |
Canonical SMILES: | C1=CN(N=C1)C2=CC=C(C=C2)F |
InChI: | InChI=1S/C9H7FN2/c10-8-2-4-9(5-3-8)12-7-1-6-11-12/h1-7H |
InChI Key: | NPJURTWXGGBFQH-UHFFFAOYSA-N |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P317, P321, P330, P337+P317, P362+P364, and P501 |
Signal Word: | Warning |
Complexity: | 144 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.05932639 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.05932639 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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