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Home > Quinoline > 130156-62-6
130156-62-6 | 3-Penten-1-one, 2-methyl-1-(8-quinolinyl)-
CAS No: 130156-62-6 Catalog No: AG000U2K MDL No:
Product Description
Catalog Number:
AG000U2K
Chemical Name:
3-Penten-1-one, 2-methyl-1-(8-quinolinyl)-
CAS Number:
130156-62-6
Molecular Formula:
C15H15NO
Molecular Weight:
225.2857
IUPAC Name:
2-methyl-1-quinolin-8-ylpent-3-en-1-one
InChI:
InChI=1S/C15H15NO/c1-3-6-11(2)15(17)13-9-4-7-12-8-5-10-16-14(12)13/h3-11H,1-2H3
InChI Key:
QOVWQXWEGKGLKF-UHFFFAOYSA-N
SMILES:
CC=CC(C(=O)c1cccc2c1nccc2)C
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.115g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.291g/mol
Monoisotopic Mass:
225.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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