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Home > Pyridines > 167020-91-9
167020-91-9 | 2-Propenoic acid, 2-methyl-, diphenyl-3-pyridinylmethyl ester
CAS No: 167020-91-9 Catalog No: AG001X37 MDL No:
Product Description
Catalog Number:
AG001X37
Chemical Name:
2-Propenoic acid, 2-methyl-, diphenyl-3-pyridinylmethyl ester
CAS Number:
167020-91-9
Molecular Formula:
C22H19NO2
Molecular Weight:
329.3918
IUPAC Name:
[diphenyl(pyridin-3-yl)methyl] 2-methylprop-2-enoate
InChI:
InChI=1S/C22H19NO2/c1-17(2)21(24)25-22(18-10-5-3-6-11-18,19-12-7-4-8-13-19)20-14-9-15-23-16-20/h3-16H,1H2,2H3
InChI Key:
OKYXDWUDRCSGQH-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)OC(c1cccnc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.142g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.399g/mol
Monoisotopic Mass:
329.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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