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893739-46-3 | 1-[2-(3-Quinolinyl)phenyl]ethanone
CAS No: 893739-46-3 Catalog No: AG01EYR3 MDL No:
Product Description
Catalog Number:
AG01EYR3
Chemical Name:
1-[2-(3-Quinolinyl)phenyl]ethanone
CAS Number:
893739-46-3
Molecular Formula:
C17H13NO
Molecular Weight:
247.2912
IUPAC Name:
1-(2-quinolin-3-ylphenyl)ethanone
InChI:
InChI=1S/C17H13NO/c1-12(19)15-7-3-4-8-16(15)14-10-13-6-2-5-9-17(13)18-11-14/h2-11H,1H3
InChI Key:
QYTSEBAQDOZWLZ-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccccc1c1cnc2c(c1)cccc2
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.297g/mol
Monoisotopic Mass:
247.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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