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Home > Aldehydes > 816446-68-1
816446-68-1 | 4-Pyridinecarboxaldehyde, 2,6-bis(4-methoxy-2-methylphenyl)-
CAS No: 816446-68-1 Catalog No: AG00584M MDL No:
Product Description
Catalog Number:
AG00584M
Chemical Name:
4-Pyridinecarboxaldehyde, 2,6-bis(4-methoxy-2-methylphenyl)-
CAS Number:
816446-68-1
Molecular Formula:
C22H21NO3
Molecular Weight:
347.4070
IUPAC Name:
2,6-bis(4-methoxy-2-methylphenyl)pyridine-4-carbaldehyde
InChI:
InChI=1S/C22H21NO3/c1-14-9-17(25-3)5-7-19(14)21-11-16(13-24)12-22(23-21)20-8-6-18(26-4)10-15(20)2/h5-13H,1-4H3
InChI Key:
SWNOHEKXWDASSZ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(nc(c1)c1ccc(cc1C)OC)c1ccc(cc1C)OC
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.152g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.414g/mol
Monoisotopic Mass:
347.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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