EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

3-benzoyl pyridine
pyridine, 3-benzoyl-

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CAS Number: 5424-19-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:226-561-3
FDA UNII:2A1326450X
Nikkaji Web:J41.578B
Beilstein Number:0120234
MDL:MFCD00006394
XlogP3:1.90 (est)
Molecular Weight:183.20993000
Formula:C12 H9 N O
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:information only not used for fragrances or flavors
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
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Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 36.00 to 40.00 °C. @ 760.00 mm Hg
Boiling Point: 307.00 °C. @ 760.00 mm Hg
Boiling Point: 319.00 to 320.00 °C. @ 760.00 mm Hg (est)
Flash Point: 302.00 °F. TCC ( 150.00 °C. )
logP (o/w): 1.880
Soluble in:
 alcohol
 water, 1317 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Flavor Type: green
">green woody fruity
Taste Description: green woody fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Carbosynth
For experimental / research use only.
Phenyl 3-pyridyl ketone
EMD Millipore
For experimental / research use only.
3-Benzoylpyridine
Santa Cruz Biotechnology
For experimental / research use only.
3-Benzoylpyridine
Sigma-Aldrich: Aldrich
For experimental / research use only.
3-Benzoylpyridine 97%
TCI AMERICA
For experimental / research use only.
3-Benzoylpyridine >99.0%(GC)
 
Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
intraperitoneal-mouse LD50 460 mg/kg
Journal of Medicinal Chemistry. Vol. 14, Pg. 551, 1971.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: information only not used for fragrances or flavors
Recommendation for 3-benzoyl pyridine usage levels up to:
 not for fragrance use.
 
Recommendation for 3-benzoyl pyridine flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :21540
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
phenyl(pyridin-3-yl)methanone
Chemidplus:0005424191
RTECS:OB6401000 for cas# 5424-19-1
 
References:
 phenyl(pyridin-3-yl)methanone
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):21540
Pubchem (sid):134984998
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2933.39.9100
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
3-benzoylpyridine
 ketone, phenyl 3-pyridyl
 methanone, phenyl-3-pyridinyl-
 methanone, phenyl-3-pyridinyl- (9CI)
 phenyl (pyridin-3-yl) methanone
 phenyl 3-pyridyl ketone
 phenyl-3-pyridyl ketone
 phenyl-b-pyridyl ketone
 phenyl-pyridin-3-yl-methanone
 phenyl(3-pyridyl)methanone
 phenyl(pyridin-3-yl)methanone
 pyridine, 3-benzoyl-
3-pyridyl phenyl ketone
 

Articles:

US Patents:3,952,024 - Furfurylthioacetone
PubMed:Time-resolved resonance Raman study of the effect of pH on the photoreactions of 3-benzoylpyridine in aqueous solution.
US Patents:Certain 2,5-dimethyl-3-thiopyrazines
PubMed:The metabolism of 3-benzoylpyridine.
PubMed:Comparative induction of CYP3A and CYP2B in rat liver by 3-benzoylpyridine and metyrapone.
PubMed:Dependence of the substrate specificity and kinetic mechanism of horse-liver alcohol dehydrogenase on the size of the C-3 pyridinium substituent. 3-Benzoylpyridine-adenine dinucleotide.
PubMed:Depression of early protection against influenza virus infection by cyclophosphamide and its restoration by Y-19995 [2,4'-bis(1-methyl-2-dimethyl-aminoethoxyl)-3-benzoylpyridine dimaleate].
PubMed:Enhancement of host defence by Y-19995 (2,4'-bis(1-methyl-2-dimethyl-aminoethoxyl)-3-benzoylpyridine dimaleate), a novel synthetic compound. I. Accelerated restoration from the leukocytopenia and augmented protection against microbial infections in immunocompromised mice.
PubMed:Enhancement of host defence by Y-19995 (2,4'-bis(1-methyl-2-dimethyl-aminoethoxyl)-3-benzoylpyridine dimaleate), a novel synthetic compound. II. Activation of phagocytic cell functions.
PubMed:Excited-state characteristics of tetracyanidonitridorhenium(V) and -technetium(V) complexes with N-heteroaromatic ligands.
PubMed:Slow magnetic relaxation in a 4,2-ribbon like Fe(III)2Co(II) heterobimetallic chain.
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:Control of radioactivity pharmacokinetics of 99mTc-HYNIC-labeled polypeptides derivatized with ternary ligand complexes.
 
Notes:
decomposition product of the soman antidote hgg-12.
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