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139399-63-6 | 8-Quinolinol, 4-bromo-
CAS No: 139399-63-6 Catalog No: AG001AXJ MDL No:MFCD08688609
Product Description
Catalog Number:
AG001AXJ
Chemical Name:
8-Quinolinol, 4-bromo-
CAS Number:
139399-63-6
Molecular Formula:
C9H6BrNO
Molecular Weight:
224.0540
MDL Number:
MFCD08688609
IUPAC Name:
4-bromoquinolin-8-ol
InChI:
InChI=1S/C9H6BrNO/c10-7-4-5-11-9-6(7)2-1-3-8(9)12/h1-5,12H
InChI Key:
CNBUFEUMIIGYIU-UHFFFAOYSA-N
SMILES:
Brc1ccnc2c1cccc2O
NSC Number:
673456
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:
2.7
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