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94071-17-7 | 6-(4-METHYLBENZOYL)PYRIDINE-2-CARBALDEHYDE
CAS No: 94071-17-7 Catalog No: AG0068UV MDL No:
Product Description
Catalog Number:
AG0068UV
Chemical Name:
6-(4-METHYLBENZOYL)PYRIDINE-2-CARBALDEHYDE
CAS Number:
94071-17-7
Molecular Formula:
C14H11NO2
Molecular Weight:
225.2426
IUPAC Name:
6-(4-methylbenzoyl)pyridine-2-carbaldehyde
InChI:
InChI=1S/C14H11NO2/c1-10-5-7-11(8-6-10)14(17)13-4-2-3-12(9-16)15-13/h2-9H,1H3
InChI Key:
YTAHFGFCIMJWOR-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(n1)C(=O)c1ccc(cc1)C
EC Number:
301-817-8
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.247g/mol
Monoisotopic Mass:
225.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Synthesis of aryl(di)azinyl ketones through copper- and iron-catalyzed oxidation of the methylene group of aryl(di)azinylmethanes. | Angewandte Chemie (International ed. in English) 20120312 |
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