5-Fluoroquinolin-2-ol

CAT: 0127-PC100791-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC100791-01Size:100 mg

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CAS Number

643752-95-8

MDL Number

MFCD18831108

Purity

97%

Smiles

C1=CC(=C2C=CC(=NC2=C1)O)F

Chemical Information

5-Fluoroquinolin-2(1h)-one

CAS Number	643752-95-8
PubChem CID	15642167
IUPAC Name	5-fluoro-1H-quinolin-2-one
Molecular Formula	C9H6FNO
Molecular Weight	163.15
XLogP	1.4
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	227

SMILES

C1=CC2=C(C=CC(=O)N2)C(=C1)F

InChI

InChI=1S/C9H6FNO/c10-7-2-1-3-8-6(7)4-5-9(12)11-8/h1-5H,(H,11,12)

InChIKey

WUWLDOZFKQIIQW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 643752-95-8

CID: 15642167

Formula: C9H6FNO

MW: 163.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	163.15
XLogP3	1.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	163.043341977
Monoisotopic Mass	163.043341977
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	227
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
LAC80202-01	2-Fluoroquinolin-7-ol
JBD31185-01	5-Fluoroquinolin-8-ol hydrobromide
JH860035	3-Bromo-5-fluoroquinolin-6-ol
LAC78449-01	8-Fluoroquinolin-3-ol
AAA39178	6-Fluoroquinolin-4-ol
440133-01	8-fluoroquinolin-4-ol
LAC58918-01	7-Fluoroquinolin-6-ol
SWB05603-01	6-Fluoroquinolin-3-ol
DWB75816-01	(5-Fluoroquinolin-8-yl) methanol
DXC60035-01	2-[ (4-Chloro-6-fluoroquinolin-8-yl) amino]ethan-1-ol