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Home > Quinoline > 189568-62-5
189568-62-5 | 1-Butanone, 1-(8-methoxy-4-propyl-3-quinolinyl)-
CAS No: 189568-62-5 Catalog No: AG002DRN MDL No:
Product Description
Catalog Number:
AG002DRN
Chemical Name:
1-Butanone, 1-(8-methoxy-4-propyl-3-quinolinyl)-
CAS Number:
189568-62-5
Molecular Formula:
C17H21NO2
Molecular Weight:
271.3541
IUPAC Name:
1-(8-methoxy-4-propylquinolin-3-yl)butan-1-one
InChI:
InChI=1S/C17H21NO2/c1-4-7-12-13-9-6-10-16(20-3)17(13)18-11-14(12)15(19)8-5-2/h6,9-11H,4-5,7-8H2,1-3H3
InChI Key:
JAJSHAYDVQCBEN-UHFFFAOYSA-N
SMILES:
CCCc1c(cnc2c1cccc2OC)C(=O)CCC
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.157g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.36g/mol
Monoisotopic Mass:
271.157g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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