2-Acetyl-6-fluoronaphthalene - CAS 33627-02-0
Catalog: |
BB075249 |
Product Name: |
2-Acetyl-6-fluoronaphthalene |
CAS: |
33627-02-0 |
Synonyms: |
1-(6-Fluoronaphthalen-2-yl)ethanone; 1-(6-Fluoronaphthalen-2-yl)ethan-1-one; 6-Fluoro-2-acetonaphthone |
IUPAC Name: | 1-(6-fluoronaphthalen-2-yl)ethanone |
Description: | 2-Acetyl-6-fluoronaphthalene is a useful research chemical compound used in the preparation of benzoyloxy naphthyl ketones from bromo ketones. |
Molecular Weight: | 188.2 |
Molecular Formula: | C12H9FO |
Canonical SMILES: | CC(=O)C1=CC2=C(C=C1)C=C(C=C2)F |
InChI: | InChI=1S/C12H9FO/c1-8(14)9-2-3-11-7-12(13)5-4-10(11)6-9/h2-7H,1H3 |
InChI Key: | TXXWLEREQYRORU-UHFFFAOYSA-N |
References: | Thirunarayanan, G., et al. Indian J. Chem. Sect. B., 50B, 4, 593-604, (2011). |
Complexity: | 226 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.063743068 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.063743068 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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