4-benzoyl pyridine
pyridine, 4-benzoyl-
Identification
| Name | 4-benzoyl pyridine |
| IUPAC | phenyl(pyridin-4-yl)methanone |
| CAS Number | 14548-46-0 |
| EINECS | 238-586-7 |
| FDA UNII | 524YQ3O21T |
| Molecular Formula | C12 H9 N O |
| Molecular Weight | 183.20993000 |
| MDL Number | MFCD00006430 |
| Nikkaji Number | J15.003G |
| Beilstein | 0003864 |
| XlogP3 | 2.00 (est) |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Melting Point | 72.00 °C. @ 760.00 mm Hg |
| Boiling Point | 315.00 °C. @ 760.00 mm Hg, 130.00 to 131.00 °C. @ 1.00 mm Hg |
| Flash Point | 302.00 °F. TCC ( 150.00 °C. ) |
| logP (o/w) | 1.980 |
| Soluble in | alcohol |
| Insoluble in | water |
No sensory data available
Safety Information
| Preferred SDS | View |
| Oral/Parenteral Toxicity | intraperitoneal-mouse LD50 520 mg/kg |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | information only not used for fragrances or flavors |
| Recommendation for 4-benzoyl pyridine usage levels up to | not for fragrance use. |
| Recommendation for 4-benzoyl pyridine flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
gamma-
benzoyl pyridine
4-
benzoylpyridine
gamma-
benzoylpyridine
ketone, phenyl 4-pyridyl
methanone, phenyl-4-pyridinyl-
phenyl (4-pyridinyl) methanone
phenyl 4-pyridyl ketone
phenyl-4-pyridinylmethanone
phenyl-pyridin-4-yl-methanone
phenyl(4-pyridinyl)methanone
phenyl(pyridin-4-yl)methanone
pyridine, 4-benzoyl-
4-
pyridyl phenyl ketone
US Patents:
3,952,024 - Furfurylthioacetone
PubMed:
Photoinduced Oxidation of Secondary Alcohols Using 4-Benzoylpyridine as an Oxidant.
US Patents:
Certain 2,5-dimethyl-3-thiopyrazines
PubMed:
Generation of free oxygen atoms O((3)P) in solution by photolysis of 4-benzoylpyridine N-oxide.
PubMed:
Synthesis, structure, spectral, thermal and first-order molecular hyperpolarizability of 4-benzoylpyridine isonicotinyl hydrazone monohydrate single crystals.
PubMed:
Two copper(II) complexes with 4-benzoylpyridine ligand: synthesis, crystal structure and luminescent properties.
PubMed:
Comparative inhibition of tetrameric carbonyl reductase activity in pig heart cytosol by alkyl 4-pyridyl ketones.
PubMed:
S-nitrosoglutathione covalently modifies cysteine residues of human carbonyl reductase 1 and affects its activity.
PubMed:
Studies on the 4-benzoylpyridine-3-carboxamide entity as a fragment model of the Isoniazid-NAD adduct.
PubMed:
Stereoselective reduction of 4-benzoylpyridine in the heart of vertebrates.
PubMed:
9,10-phenanthrenequinone, a component of diesel exhaust particles, inhibits the reduction of 4-benzoylpyridine and all-trans-retinal and mediates superoxide formation through its redox cycling in pig heart.
PubMed:
Towards the chemical control of molecular packing: syntheses and crystal structures of three trans-[NiL4(NCS)2] complexes.
PubMed:
Possible mechanism of superoxide formation through redox cycling of plumbagin in pig heart.
PubMed:
Different topologies in three manganese-μ-azido 1D compounds: magnetic behavior and DFT-quantum Monte Carlo calculations.
PubMed:
Rhenium-to-benzoylpyridine and rhenium-to-bipyridine MLCT excited states of fac-[Re(Cl)(4-benzoylpyridine)(2)(CO)(3)] and fac-[Re(4-benzoylpyridine)(CO)(3)(bpy)](+): a time-resolved spectroscopic and spectroelectrochemical study.
PubMed:
Two new one-dimensional compounds with end-to-end dicyanamide as a bridging ligand: syntheses and structural characterization of trans-[Mn(4-bzpy)2(N(CN)2)2]n and cis-[Mn(Bpy)(N(CN)2)2]n, (4-bzpy = 4-benzoylpyridine; bpy = 2,2'-bipyridyl).
PubMed:
Excited-state characteristics of tetracyanidonitridorhenium(V) and -technetium(V) complexes with N-heteroaromatic ligands.
PubMed:
Interindividual variability of carbonyl reductase levels in human livers.
PubMed:
Involvement of carbonyl reductase in superoxide formation through redox cycling of adrenochrome and 9,10-phenanthrenequinone in pig heart.
PubMed:
Inhibitory effects of flavonoids on rabbit heart carbonyl reductase.
PubMed:
Purification and catalytic properties of a tetrameric carbonyl reductase from rabbit heart.
PubMed:
Immunohistochemical localization and physiological regulation of carbonyl reductase in immature rat ovary.
PubMed:
Structural combination of established 5-HT(2A) receptor ligands: new aspects of the binding mode.
PubMed:
[Structure and function of peroxisomal tetrameric carbonyl reductase].
PubMed:
Luminescence ranging from red to blue: a series of copper(I)-halide complexes having rhombic {Cu2(mu-X)2} (X = Br and I) units with N-heteroaromatic ligands.
PubMed:
Inhibition of rabbit heart carbonyl reductase by fatty acids.
PubMed:
Characterization of multiple forms of carbonyl reductase from chicken liver.
PubMed:
Effects of antiestrogens on ovarian aldo-keto reductase in relation to ovulation in rats.
PubMed:
Regulation of ovarian carbonyl reductase mediated by estrogen receptor in immature rats.
PubMed:
Carbonyl reductases from rat testis and vas deferens. Purification, properties and localization.
PubMed:
Different functions between human monomeric carbonyl reductase 3 and carbonyl reductase 1.
PubMed:
Inhibition of carbonyl reductase activity in pig heart by alkyl phenyl ketones.
PubMed:
Differences in catalytic activity between rat testicular and ovarian carbonyl reductases are due to two amino acids.
PubMed:
Characterization of multiple Chinese hamster carbonyl reductases.
PubMed:
Pre- and post-ovulatory changes in carbonyl reductase in ovarian follicles and corpora lutea in rats.
PubMed:
Carbonyl reductase activity exhibited by pig testicular 20 beta-hydroxysteroid dehydrogenase.
PubMed:
Inhibition of pink color development in cooked, uncured ground turkey through the binding of non-pink generating ligands to muscle pigments.
PubMed:
Effects of psychotropic drugs on aldo-keto reductase activity in rat ovary and adrenal gland.
PubMed:
Purification and characterization of 5 alpha-dihydrotestosterone 3 beta-hydroxysteroid dehydrogenase from mature pig testicular cytosol.
PubMed:
Structural requirements for the induction of hepatic microsomal cytochrome P450 by imidazole- and pyridine-containing compounds in rats.
PubMed:
Changes and localization of ovarian carbonyl reductase during pseudopregnancy and pregnancy in rats.
PubMed:
Physiological role of ovarian carbonyl reductase and effect of antiestrogen on its activity in rats.
PubMed:
Kinetic mechanisms in the reduction of aldehydes and ketones catalyzed by rabbit liver aldehyde reductases and hydroxysteroid dehydrogenases.