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Home> Hot Product Listed 4   > 4-Pyridinecarboxaldehyde,oxime, 1-oxide
67483-49-2 structure

4-Pyridinecarboxaldehyde,oxime, 1-oxide

Iupac Name:3,4-dimethoxy-5-prop-2-enylbenzaldehyde
CAS No.:67483-49-2
Molecular Weight:206.241
Molecular Formula:C11H18N2O2S (isomer)
Names and Identifiers
Synonyms

Isonicotinaldehyde,oxime, 1-oxide (6CI,7CI,8CI) Pyridine-N-oxide-4-carbaldoxime

Inchi
InChI=1S/C12H14O3/c1-4-5-10-6-9(8-13)7-11(14-2)12(10)15-3/h4,6-8H,1,5H2,2-3H3
InChkey
FBLUJEZNJVZMKK-UHFFFAOYSA-N
Canonical Smiles
COC1=CC(=CC(=C1OC)CC=C)C=O
Properties
Boiling Point
489.7°Cat760mmHg
Refractive Index
1.535
Flash Point
°C
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:206.241g/mol
  • Molecular Formula:C11H18N2O2S
  • Compound Is Canonicalized:True
  • Exact Mass:206.094
  • Monoisotopic Mass:206.094
  • Complexity:215
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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