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29724-68-3 | Methanone, phenyl-1(2H)-quinolinyl-
CAS No: 29724-68-3 Catalog No: AG002Z86 MDL No:
Product Description
Catalog Number:
AG002Z86
Chemical Name:
Methanone, phenyl-1(2H)-quinolinyl-
CAS Number:
29724-68-3
Molecular Formula:
C16H13NO
Molecular Weight:
235.2805
IUPAC Name:
phenyl(2H-quinolin-1-yl)methanone
InChI:
InChI=1S/C16H13NO/c18-16(14-8-2-1-3-9-14)17-12-6-10-13-7-4-5-11-15(13)17/h1-11H,12H2
InChI Key:
RSIOYTUKUFAJPC-UHFFFAOYSA-N
SMILES:
O=C(N1CC=Cc2c1cccc2)c1ccccc1
NSC Number:
266119
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.286g/mol
Monoisotopic Mass:
235.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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