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Home > Pyridines > 150701-11-4
150701-11-4 | 2,2'-Bipyridine, 4-[(1E)-2-(2,5-dimethoxyphenyl)ethenyl]-4'-methyl-
CAS No: 150701-11-4 Catalog No: AG001MST MDL No:
Product Description
Catalog Number:
AG001MST
Chemical Name:
2,2'-Bipyridine, 4-[(1E)-2-(2,5-dimethoxyphenyl)ethenyl]-4'-methyl-
CAS Number:
150701-11-4
Molecular Formula:
C21H20N2O2
Molecular Weight:
332.3957
IUPAC Name:
2-[4-[2-(2,5-dimethoxyphenyl)ethenyl]pyridin-2-yl]-4-methylpyridine
InChI:
InChI=1S/C21H20N2O2/c1-15-8-10-22-19(12-15)20-13-16(9-11-23-20)4-5-17-14-18(24-2)6-7-21(17)25-3/h4-14H,1-3H3
InChI Key:
DEVQFGNAPQUGLU-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1/C=C/c1ccnc(c1)c1nccc(c1)C)OC
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.152g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.403g/mol
Monoisotopic Mass:
332.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
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