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Home > Aldehydes > 1226166-63-7
1226166-63-7 | 2-(4-Methylphenyl)isonicotinaldehyde
CAS No: 1226166-63-7 Catalog No: AG01FDFQ MDL No:
Product Description
Catalog Number:
AG01FDFQ
Chemical Name:
2-(4-Methylphenyl)isonicotinaldehyde
CAS Number:
1226166-63-7
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
IUPAC Name:
2-(4-methylphenyl)pyridine-4-carbaldehyde
InChI:
InChI=1S/C13H11NO/c1-10-2-4-12(5-3-10)13-8-11(9-15)6-7-14-13/h2-9H,1H3
InChI Key:
HKSBPMRIFIODEZ-UHFFFAOYSA-N
SMILES:
O=Cc1ccnc(c1)c1ccc(cc1)C
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.237g/mol
Monoisotopic Mass:
197.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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