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

4-pyridine carboxaldehyde
isonicotinaldehyde

Supplier Sponsors

Name:pyridine-4-carbaldehyde
CAS Number: 872-85-5Picture of molecule3D/inchi
Other(deleted CASRN):942039-01-2
ECHA EINECS - REACH Pre-Reg:212-832-3
FDA UNII: Search
Nikkaji Web:J28.013E
Beilstein Number:0105342
MDL:MFCD00006425
XlogP3:0.40 (est)
Molecular Weight:107.11205000
Formula:C6 H5 N O
NMR Predictor:Predict (works with chrome, Edge 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
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.13700 to 1.14200 @ 20.00 °C.
Pounds per Gallon - (est).: 9.472 to 9.514
Refractive Index:1.54200 to 1.54600 @ 20.00 °C.
Melting Point: -4.00 °C. @ 760.00 mm Hg
Boiling Point: 187.00 °C. @ 760.00 mm Hg
Boiling Point: 192.00 to 193.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.242000 mmHg @ 25.00 °C. (est)
Flash Point: 130.00 °F. TCC ( 54.44 °C. )
logP (o/w): 0.430
Soluble in:
 water, 4.774e+004 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Flavor Type: fruity
fruity
Taste Description: fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Pyridine-4-carbaldehyde 97%
Matrix Scientific
For experimental / research use only.
Pyridine-4-carbaldehyde, 97%
sds
Noble Molecular Research
For experimental / research use only.
4-Pyridinecarboxaldehyde
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-Pyridinecarboxaldehyde 97%
sds
TCI AMERICA
For experimental / research use only.
4-Pyridinecarboxaldehyde >96.0%(GC)
sds
 
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:
oral-mouse LDLo 1600 mg/kg
Archives of Environmental Contamination and Toxicology. Vol. 14, Pg. 111, 1985.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
information only not used for fragrances or flavors
Recommendation for 4-pyridine carboxaldehyde usage levels up to:
 not for fragrance use.
 
Recommendation for 4-pyridine carboxaldehyde flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):872-85-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :13389
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:1
pyridine-4-carbaldehyde
Chemidplus:0000872855
RTECS:NR9400000 for cas# 872-85-5
 
References:
 pyridine-4-carbaldehyde
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:872-85-5
Pubchem (cid):13389
Pubchem (sid):134980918
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEMBL:View
UM BBD:Search
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:
4-formylpyridine
p-formylpyridine
isonicotinaldehyde
isonicotinic aldehyde
4-pyridine aldehyde
 pyridine-4-aldehyde
 pyridine-4-carbaldehyde
 pyridine-4-carboxaldehyde
 pyridine-4-ylcarboxaldehyde
4-pyridinealdehyde
p-pyridinealdehyde
4-pyridinecarboxaldehyde
(4-pyridinecarboxaldehyde)
4-pyridylaldehyde
 

Articles:

US Patents:3,952,024 - Furfurylthioacetone
PubMed:The involvement of P2Y12 receptors, NADPH oxidase, and lipid rafts in the action of extracellular ATP on synaptic transmission at the frog neuromuscular junction.
US Patents:Certain 2,5-dimethyl-3-thiopyrazines
PubMed:[Live cell fluorescent imaging and cytotoxicity assessment of pH fluorescent probe based on styrylcyanine dyes].
PubMed:Heterogeneous carbon gels: N-doped carbon xerogels from resorcinol and N-containing heterocyclic aldehydes.
PubMed:Biaryl amides and hydrazones as therapeutics for prion disease in transgenic mice.
PubMed:Comparative studies of structural, thermal, optical, and electrochemical properties of azines with different end groups with their azomethine analogues toward application in (opto)electronics.
PubMed:A novel ruthenium(II)-cobaloxime supramolecular complex for photocatalytic H2 evolution: synthesis, characterisation and mechanistic studies.
PubMed:The binding of β-d-glucopyranosyl-thiosemicarbazone derivatives to glycogen phosphorylase: A new class of inhibitors.
PubMed:Preparation and characterization of N-heterocyclic chitosan derivative based gels for biomedical applications.
PubMed:Excitation-energy dependence of the phosphorescence quantum yields of pyridinecarboxaldehyde vapors.
PubMed:Probing lead(II) bonding environments in 4-substituted pyridine adducts of (2,6-Me2C6H3S)2Pb: an X-ray structural and solid-state 207Pb NMR study.
PubMed:Emission spectra and electronic energy levels of the rotational isomers of pyridinecarboxaldehyde vapors.
PubMed:Enhancement of metal-metal coupling at a considerable distance by using 4-pyridinealdazine as a bridging ligand in polynuclear complexes of rhenium and ruthenium.
PubMed:Noncentrosymmetric organic solids with very strong harmonic generation response.
PubMed:Dibromo(pyridoxal semicarbazone-kappa3N1,O3,O3')copper(II).
PubMed:Pillared, 3D metal-organic frameworks with rectangular channels. Synthesis and characterization of coordination polymers based on tricadmium carboxylates.
PubMed:Synthesis and calcium channel-modulating effects of alkyl (or cycloalkyl) 1,4-dihydro-2,6-dimethyl-3-nitro-4-pyridyl-5-pyridinecarboxylate racemates and enantiomers.
PubMed:Large Molecular Quadratic Hyperpolarizabilities in Donor/Acceptor-Substituted trans-Tetraammineruthenium(II) Complexes.
PubMed:Syntheses, calcium channel agonist-antagonist modulation activities, and voltage-clamp studies of isopropyl 1,4-dihydro-2,6-dimethyl-3-nitro-4-pyridinylpyridine-5-carboxylate racemates and enantiomers.
PubMed:Aromatase inhibitors. Syntheses and structure-activity studies of novel pyridyl-substituted indanones, indans, and tetralins.
PubMed:New aromatase inhibitors. Synthesis and biological activity of pyridyl-substituted tetralone derivatives.
PubMed:Relationship between structure and antineoplastic activity of (arylsulfonyl)hydrazones of 4-pyridinecarboxaldehyde.
PubMed:The binding affinity of amphetamine to 4-pyridinecarboxaldehyde and the coenzymes pyridoxal and pyridoxal-5-phosphate.
PubMed:[Reactivation of phosphorylated acetylcholinesterase (AChE): quaternary salts of vinylogous pyridinaldoxims (author's transl)].
PubMed:[Quantitative determination of alkylating cytostatics on TLC plate with 4-pyridinecarboxaldehyde-2-benzothiazolylhydrazone].
PubMed:5-(2-Chloroethyl)-3-hydroxy-2-methyl-4-pyridinecarboxaldehyde ( 5 -pyridoxal methyl chloride) and its reaction with N -acetyl-L-lysine to form a new cyclic imino acid derivative of homopyridoxal.
PubMed:Xanthine oxidase catalyzed oxidation of aldehydes. Oxidation of aliphatic aldehydes and 2- and 4-pyridinecarboxaldehyde.
PubMed:Photoinactivation of aldolases by pyridoxal phosphate and its analogues.
 
Notes:
None found
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