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77587-25-8 | 2(1H)-Quinolinone, 3-[(2E)-3,7-dimethyl-2,6-octadienyl]-4-hydroxy-
CAS No: 77587-25-8 Catalog No: AG008OV2 MDL No:
Product Description
Catalog Number:
AG008OV2
Chemical Name:
2(1H)-Quinolinone, 3-[(2E)-3,7-dimethyl-2,6-octadienyl]-4-hydroxy-
CAS Number:
77587-25-8
Molecular Formula:
C19H23NO2
Molecular Weight:
297.3914
IUPAC Name:
3-(3,7-dimethylocta-2,6-dienyl)-4-hydroxy-1H-quinolin-2-one
InChI:
InChI=1S/C19H23NO2/c1-13(2)7-6-8-14(3)11-12-16-18(21)15-9-4-5-10-17(15)20-19(16)22/h4-5,7,9-11H,6,8,12H2,1-3H3,(H2,20,21,22)
InChI Key:
HFTSBBYLFBZPQB-UHFFFAOYSA-N
SMILES:
C/C(=C\Cc1c(=O)[nH]c2c(c1O)cccc2)/CCC=C(C)C
Properties
Complexity:
510
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.173g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.398g/mol
Monoisotopic Mass:
297.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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