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869318-49-0 | 8-Quinolinol, 5-[(4-cycloocten-1-yloxy)methyl]-
CAS No: 869318-49-0 Catalog No: AG004I51 MDL No:
Product Description
Catalog Number:
AG004I51
Chemical Name:
8-Quinolinol, 5-[(4-cycloocten-1-yloxy)methyl]-
CAS Number:
869318-49-0
Molecular Formula:
C18H21NO2
Molecular Weight:
283.3648
IUPAC Name:
5-(cyclooct-4-en-1-yloxymethyl)quinolin-8-ol
InChI:
InChI=1S/C18H21NO2/c20-17-11-10-14(16-9-6-12-19-18(16)17)13-21-15-7-4-2-1-3-5-8-15/h1-2,6,9-12,15,20H,3-5,7-8,13H2
InChI Key:
URVDBASMIMOTHZ-UHFFFAOYSA-N
SMILES:
Oc1ccc(c2c1nccc2)COC1CCCC=CCC1
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.157g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.371g/mol
Monoisotopic Mass:
283.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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