2'-Fluoroacetophenone - CAS 445-27-2
Catalog: |
BB025634 |
Product Name: |
2'-Fluoroacetophenone |
CAS: |
445-27-2 |
Synonyms: |
1-(2-fluorophenyl)ethanone |
IUPAC Name: | 1-(2-fluorophenyl)ethanone |
Description: | 2'-Fluoroacetophenone (CAS# 445-27-2) is useful for preparing herbicides. |
Molecular Weight: | 138.14 |
Molecular Formula: | C8H7FO |
Canonical SMILES: | CC(=O)C1=CC=CC=C1F |
InChI: | InChI=1S/C8H7FO/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,1H3 |
InChI Key: | QMATYTFXDIWACW-UHFFFAOYSA-N |
Boiling Point: | 82-83 °C (10 mmHg) |
Melting Point: | 26-27 °C |
Purity: | 97 % |
Density: | 1.137 g/cm3 |
Appearance: | Clear colorless to light yellow or light green |
Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00000320 |
LogP: | 2.02830 |
Publication Number | Title | Priority Date |
CN-112961092-A | Preparation method of vonoprazan fumarate intermediate | 20210317 |
CN-111909194-A | Method for catalyzing ketone cyanogen silicification reaction by deprotonated phenyl bridging beta-ketimine lithium complex | 20200819 |
WO-2021097139-A1 | Chiral synthesis of a tertiary alcohol | 20191115 |
CN-110845437-A | Method for preparing 2-aminothiazole compound | 20191113 |
CN-111019915-A | Application of carbonyl reductase mutant in synthesis of chiral ortho-halogenated- α -phenethyl alcohol | 20191108 |
PMID | Publication Date | Title | Journal |
22864261 | 20120918 | Total synthesis of ascididemin via anionic cascade ring closure | Chemical communications (Cambridge, England) |
21165517 | 20110314 | Preparation of surface molecularly imprinted Ru-complex catalysts for asymmetric transfer hydrogenation in water media | Dalton transactions (Cambridge, England : 2003) |
15147713 | 20040601 | Estimations of excited state dipole moments of conformers in some o-substituted acetophenones by solvato-chromic shifts | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
12778733 | 20030521 | Biocatalytic reduction of ketones by a semi-continuous flow process using supercritical carbon dioxide | Chemical communications (Cambridge, England) |
Complexity: | 133 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 138.048093005 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 138.048093005 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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