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88844-62-6 | 2-Propen-1-one,1-(6-methyl-3-pyridinyl)-3-phenyl-
CAS No: 88844-62-6 Catalog No: AG0049ZU MDL No:
Product Description
Catalog Number:
AG0049ZU
Chemical Name:
2-Propen-1-one,1-(6-methyl-3-pyridinyl)-3-phenyl-
CAS Number:
88844-62-6
Molecular Formula:
C15H13NO
Molecular Weight:
223.2698
IUPAC Name:
1-(6-methylpyridin-3-yl)-3-phenylprop-2-en-1-one
InChI:
InChI=1S/C15H13NO/c1-12-7-9-14(11-16-12)15(17)10-8-13-5-3-2-4-6-13/h2-11H,1H3
InChI Key:
UVTSQTMREZHBRA-UHFFFAOYSA-N
SMILES:
Cc1ccc(cn1)C(=O)C=Cc1ccccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.275g/mol
Monoisotopic Mass:
223.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3
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