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Home > Aldehydes > 847446-84-8
847446-84-8 | Benzaldehyde,4-(3-methyl-2-pyridinyl)-
CAS No: 847446-84-8 Catalog No: AG004YDP MDL No:
Product Description
Catalog Number:
AG004YDP
Chemical Name:
Benzaldehyde,4-(3-methyl-2-pyridinyl)-
CAS Number:
847446-84-8
Molecular Formula:
C13H11NO
Molecular Weight:
197.2325
IUPAC Name:
4-(3-methylpyridin-2-yl)benzaldehyde
InChI:
InChI=1S/C13H11NO/c1-10-3-2-8-14-13(10)12-6-4-11(9-15)5-7-12/h2-9H,1H3
InChI Key:
ASHNBGQNIQIZTC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ncccc1C
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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