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648896-59-7 | 8-Quinolinol, 7-iodo-5-(2-methylphenyl)-
CAS No: 648896-59-7 Catalog No: AG006RXF MDL No:
Product Description
Catalog Number:
AG006RXF
Chemical Name:
8-Quinolinol, 7-iodo-5-(2-methylphenyl)-
CAS Number:
648896-59-7
Molecular Formula:
C16H12INO
Molecular Weight:
361.1771
IUPAC Name:
7-iodo-5-(2-methylphenyl)quinolin-8-ol
InChI:
InChI=1S/C16H12INO/c1-10-5-2-3-6-11(10)13-9-14(17)16(19)15-12(13)7-4-8-18-15/h2-9,19H,1H3
InChI Key:
LGLYBLHTMUXBPK-UHFFFAOYSA-N
SMILES:
Cc1ccccc1c1cc(I)c(c2c1cccn2)O
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.996g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
361.182g/mol
Monoisotopic Mass:
360.996g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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