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71456-77-4 | Quinoline, 8,8'-[1,5-pentanediylbis(oxy)]bis-
CAS No: 71456-77-4 Catalog No: AG0067WU MDL No:
Product Description
Catalog Number:
AG0067WU
Chemical Name:
Quinoline, 8,8'-[1,5-pentanediylbis(oxy)]bis-
CAS Number:
71456-77-4
Molecular Formula:
C23H22N2O2
Molecular Weight:
358.4330
IUPAC Name:
8-(5-quinolin-8-yloxypentoxy)quinoline
InChI:
InChI=1S/C23H22N2O2/c1(2-16-26-20-12-4-8-18-10-6-14-24-22(18)20)3-17-27-21-13-5-9-19-11-7-15-25-23(19)21/h4-15H,1-3,16-17H2
InChI Key:
WWYNAXYROFWLPC-UHFFFAOYSA-N
SMILES:
C(CCOc1cccc2c1nccc2)CCOc1cccc2c1nccc2
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.168g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.441g/mol
Monoisotopic Mass:
358.168g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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