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115581-09-4 | 6-Quinolinol, 5-bromo-
CAS No: 115581-09-4 Catalog No: AG000G7H MDL No:
Product Description
Catalog Number:
AG000G7H
Chemical Name:
6-Quinolinol, 5-bromo-
CAS Number:
115581-09-4
Molecular Formula:
C9H6BrNO
Molecular Weight:
224.0540
IUPAC Name:
5-bromoquinolin-6-ol
InChI:
InChI=1S/C9H6BrNO/c10-9-6-2-1-5-11-7(6)3-4-8(9)12/h1-5,12H
InChI Key:
HQEFDTSINGDBKQ-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1Br)cccn2
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.963g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.057g/mol
Monoisotopic Mass:
222.963g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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