3-(3-Fluorophenyl)-1,2,4-oxadiazole - CAS 1262412-46-3
Catalog: |
BB064685 |
Product Name: |
3-(3-Fluorophenyl)-1,2,4-oxadiazole |
CAS: |
1262412-46-3 |
Synonyms: |
3-(3-fluorophenyl)-1,2,4-oxadiazole |
IUPAC Name: | 3-(3-fluorophenyl)-1,2,4-oxadiazole |
Description: | 3-(3-Fluorophenyl)-1,2,4-oxadiazole |
Molecular Weight: | 164.14 |
Molecular Formula: | C8H5FN2O |
Canonical SMILES: | C1=CC(=CC(=C1)F)C2=NOC=N2 |
InChI: | InChI=1S/C8H5FN2O/c9-7-3-1-2-6(4-7)8-10-5-12-11-8/h1-5H |
InChI Key: | SQHQKHGSNYSZMC-UHFFFAOYSA-N |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.03859095 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.03859095 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 38.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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