2-(4-Chloro-2-fluorophenyl)-1,3,4-oxadiazole - CAS 1820711-18-9
Catalog: |
BB069389 |
Product Name: |
2-(4-Chloro-2-fluorophenyl)-1,3,4-oxadiazole |
CAS: |
1820711-18-9 |
Synonyms: |
2-(4-Chloro-2-fluorophenyl)-1,3,4-oxadiazole |
IUPAC Name: | 2-(4-chloro-2-fluorophenyl)-1,3,4-oxadiazole |
Description: | 2-(4-Chloro-2-fluorophenyl)-1,3,4-oxadiazole |
Molecular Weight: | 198.58 |
Molecular Formula: | C8H4ClFN2O |
Canonical SMILES: | C1=CC(=C(C=C1Cl)F)C2=NN=CO2 |
InChI: | InChI=1S/C8H4ClFN2O/c9-5-1-2-6(7(10)3-5)8-12-11-4-13-8/h1-4H |
InChI Key: | QSKOPXOPCFHULF-UHFFFAOYSA-N |
Complexity: | 184 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.9996186 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.9996186 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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