3-Fluoro-5-[2-(trifluoromethyl)phenyl]pyridine - CAS 1261600-84-3
Catalog: |
BB064799 |
Product Name: |
3-Fluoro-5-[2-(trifluoromethyl)phenyl]pyridine |
CAS: |
1261600-84-3 |
Synonyms: |
3-Fluoro-5-[2-(trifluoromethyl)phenyl]pyridine; 3-Fluoro-5-(2-(trifluoromethyl)phenyl)pyridine |
IUPAC Name: | 3-fluoro-5-[2-(trifluoromethyl)phenyl]pyridine |
Description: | 3-Fluoro-5-[2-(trifluoromethyl)phenyl]pyridine |
Molecular Weight: | 241.18 |
Molecular Formula: | C12H7F4N |
Canonical SMILES: | C1=CC=C(C(=C1)C2=CC(=CN=C2)F)C(F)(F)F |
InChI: | InChI=1S/C12H7F4N/c13-9-5-8(6-17-7-9)10-3-1-2-4-11(10)12(14,15)16/h1-7H |
InChI Key: | KZMQUSLUQIUOOA-UHFFFAOYSA-N |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.05146188 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.05146188 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 12.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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