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7654-96-8 | 8-Quinolinol, 5-[(heptyloxy)methyl]-
CAS No: 7654-96-8 Catalog No: AG005WZ4 MDL No:
Product Description
Catalog Number:
AG005WZ4
Chemical Name:
8-Quinolinol, 5-[(heptyloxy)methyl]-
CAS Number:
7654-96-8
Molecular Formula:
C17H23NO2
Molecular Weight:
273.3700
IUPAC Name:
5-(heptoxymethyl)quinolin-8-ol
InChI:
InChI=1S/C17H23NO2/c1-2-3-4-5-6-12-20-13-14-9-10-16(19)17-15(14)8-7-11-18-17/h7-11,19H,2-6,12-13H2,1H3
InChI Key:
IQWBNWLLEUMLQK-UHFFFAOYSA-N
SMILES:
CCCCCCCOCc1ccc(c2c1cccn2)O
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.173g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.376g/mol
Monoisotopic Mass:
273.173g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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