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71970-43-9 | 3,5-Pyridinedicarboxaldehyde,1,4-dihydro-4-methyl-
CAS No: 71970-43-9 Catalog No: AG005OTH MDL No:
Product Description
Catalog Number:
AG005OTH
Chemical Name:
3,5-Pyridinedicarboxaldehyde,1,4-dihydro-4-methyl-
CAS Number:
71970-43-9
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
IUPAC Name:
4-methyl-1,4-dihydropyridine-3,5-dicarbaldehyde
InChI:
InChI=1S/C8H9NO2/c1-6-7(4-10)2-9-3-8(6)5-11/h2-6,9H,1H3
InChI Key:
GHUJOXJDUAROKJ-UHFFFAOYSA-N
SMILES:
O=CC1=CNC=C(C1C)C=O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Natural antibodies of newborns recognize oxidative stress-related malondialdehyde acetaldehyde adducts on apoptotic cells and atherosclerotic plaques. | International immunology 20131001 |
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