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65826-84-8 | 1-Nonanone, 1-(8-quinolinyl)-
CAS No: 65826-84-8 Catalog No: AG006O6Y MDL No:
Product Description
Catalog Number:
AG006O6Y
Chemical Name:
1-Nonanone, 1-(8-quinolinyl)-
CAS Number:
65826-84-8
Molecular Formula:
C18H23NO
Molecular Weight:
269.3813
IUPAC Name:
1-quinolin-8-ylnonan-1-one
InChI:
InChI=1S/C18H23NO/c1-2-3-4-5-6-7-13-17(20)16-12-8-10-15-11-9-14-19-18(15)16/h8-12,14H,2-7,13H2,1H3
InChI Key:
BBSNCGGHEFNVAD-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(=O)c1cccc2c1nccc2
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.178g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.388g/mol
Monoisotopic Mass:
269.178g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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