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3-pyridine carboxaldehyde

Chemical Structure

General Material Information

Preferred name 3-pyridine carboxaldehyde
Trivial Name 3-Pyridinecarboxaldehyde
Short Description nicotinealdehyde
Formula C6 H5 N O
CAS Number 500-22-1
ECHA Number 207-900-4
FDA UNII 840R4IDQ1T
Nikkaji Number J28.015A
Beilstein Number 0105343
MDL MFCD00006382
xLogP3-AA 0.30 (est)
Bio Activity Summary External link
NMR Predictor External link
Synonyms
  • 3-formyl pyridine
  • 3-formylpyridine
  • nicotinaldehyde
  • nicotinealdehyde
  • nicotinic aldehyde
  • 3-pyridenecarboxaldehyde
  • 3-pyridinaldehyde
  • 3-pyridine aldehyde
  • pyridine-3-aldehyde
  • pyridine-3-carbaldehyde
  • pyridine-3-carboxaldehyde
  • 3-pyridinealdehyde
  • .beta.- pyridinecarbonaldehyde
  • beta- pyridinecarbonaldehyde
  • 3-pyridinecarboxaldehyde
  • 3-pyridylaldehyde
  • 3-pyridylcarboxaldehyde
  • 3-Pyridinecarboxaldehyde
  • 3-Pyridinealdehyde
  • β-Pyridinecarbonaldehyde
  • Rowalind
  • 3-Pyridylcarboxaldehyde
  • 3-Pyridinaldehyde
  • 3-Formylpyridine
  • 3-Pyridylaldehyde
  • β-Formylpyridine
  • m-Formylpyridine
  • NSC 8952
  • Pyridine-5-carboxaldehyde
  • 3-Pyridylcarboxyaldehyde
  • Pyridine-3-formaldehyde

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Literature & References

pyridine-3-carbaldehyde
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:500-22-1
Pubchem (cid):10371
Pubchem (sid):134977971
Pherobase:View
Publications by US Patents
3,952,024 - Furfurylthioacetone
Certain 2,5-dimethyl-3-thiopyrazines
Publications by PubMed
Cyclizations of phenylethyl-substituted pyridinecarboxaldehydes.
Synthesis and antimycobacterial activity of 2,1'-dihydropyridomycins.
Tetra-kis(μ-acetato-κ(2)O:O')-bis-[(3-pyridine-carboxaldehyde-κN')]dicopper(II)(Cu-Cu).
Application of porous nickel-coated TiO₂ for the photocatalytic degradation of aqueous quinoline in an internal airlift loop reactor.
2-Chloro- and 2-bromo-3-pyridinecarboxaldehydes: structures, rotamers, fermi resonance and vibration modes.
Noncentrosymmetric organic solids with very strong harmonic generation response.
Competitive Intramolecular/Intermolecular Chelation Options Operative during Indium-Promoted Additions to Pyridyl Aldehydes and to Glyoxylic Acid under Aqueous Conditions.
Efficient enantiomeric synthesis of pyrrolidine and piperidine alkaloids from tobacco.
Milameline (CI-979/RU35926): a muscarinic receptor agonist with cognition-activating properties: biochemical and in vivo characterization.
Synthesis of a novel dual inhibitor of thromboxane A2 synthetase and 5-lipoxygenase (E3040) via the direct coupling reaction of hydroquinone with 3-pyridinecarboxaldehyde.
Safety and tolerability of CI-979 in patients with Alzheimer's disease.
Chemotherapeutic agents, XXI: Synthesis of Pi-deficient pyrimidines as leishmanicides.
Purification and Properties of an NADPH-Aldose Reductase (Aldehyde Reductase) from Euonymus japonica Leaves.
Partial Purification and Characterization of d-Ribose-5-phosphate Reductase from Adonis vernalis L. Leaves.
Inhibition of xanthine oxidase by various aldehydes.
Tissue distribution of mammalian aldose reductase and related enzymes.

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
CHEBI:View
CHEMBL:View
KEGG (GenomeNet):C07327
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2933.39.9100
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 107.11205291748
Specific gravity @ 20 °C
Pounds per Gallon 9.522 to 9.547
Refractive Index 1.547 to 1.551 @ 20 °C
Boiling Point 209 to 210°C @ 760 mm Hg
Boiling Point 95 to 97°C @ 15 mm Hg
Vapor Pressure 0.2 mmHg @ 25 °C
Flash Point TCC Value 60 °C TCC
logP (o/w) 0.29
Solubility
water, 6.286e+004 mg/L @ 25 °C (est) Yes

Organoleptic Properties

Flavor Type: Bitter
bitter, astringent
General comment Bitter astringent

Occurrences

Safety Information

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 LD25 720 mg/kg
Journal of Pharmaceutical Sciences. Vol. 64, Pg. 528, 1975.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
antimicrobial agents
Recommendation for 3-pyridine carboxaldehyde usage levels up to:
not for fragrance use.
Recommendation for 3-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):500-22-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :10371
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
pyridine-3-carbaldehyde
Chemidplus:0000500221
RTECS:QS2980000 for cas# 500-22-1