3- Bromo- 2- fluoro-4-pyridinecarbonitrile - CAS 1807022-80-5
Catalog: |
BB072029 |
Product Name: |
3- Bromo- 2- fluoro-4-pyridinecarbonitrile |
CAS: |
1807022-80-5 |
Synonyms: |
3-Bromo-2-fluoroisonicotinonitrile; 3-bromo-2-fluoropyridine-4-carbonitrile |
IUPAC Name: | 3-bromo-2-fluoropyridine-4-carbonitrile |
Description: | 3- Bromo- 2- fluoro-4-pyridinecarbonitrile is a useful synthetic intermediate. |
Molecular Weight: | 201 |
Molecular Formula: | C6H2BrFN2 |
Canonical SMILES: | C1=CN=C(C(=C1C#N)Br)F |
InChI: | InChI=1S/C6H2BrFN2/c7-5-4(3-9)1-2-10-6(5)8/h1-2H |
InChI Key: | GPHPXMDXYYFSJY-UHFFFAOYSA-N |
Complexity: | 164 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.93854 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.93854 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 36.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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