3-Fluoroquinolin-5-amine

CAT: 0127-PC102354-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC102354-01Size:100 mg

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CAS Number

155014-05-4

MDL Number

MFCD02752401

Purity

98%

Smiles

NC1=C2C=C(F)C=NC2=CC=C1

Chemical Information

3-Fluoro-5-aminoquinoline

CAS Number	155014-05-4
PubChem CID	154677
IUPAC Name	3-fluoroquinolin-5-amine
Molecular Formula	C9H7FN2
Molecular Weight	162.16
XLogP	1.3
Topological Polar Surface Area	38.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	163

SMILES

C1=CC(=C2C=C(C=NC2=C1)F)N

InChI

InChI=1S/C9H7FN2/c10-6-4-7-8(11)2-1-3-9(7)12-5-6/h1-5H,11H2

InChIKey

QXOIWROBEFMORO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 155014-05-4

CID: 154677

Formula: C9H7FN2

MW: 162.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.16
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	162.05932639
Monoisotopic Mass	162.05932639
Topological Polar Surface Area	38.9 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	163
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
LMB32421-01	8-Fluoroquinolin-3-amine
RGC43907-01	4-Fluoroquinolin-8-amine
CPC16676-01	4-Chloro-8-fluoroquinolin-3-amine
JH860035	3-Bromo-5-fluoroquinolin-6-ol
sc-493704	3-[ (3,5-dichlorophenyl) sulfonyl]-N-[3- (3,5-dimethylisoxazol-4-yl) propyl]-7-fluoroquinolin-4-amine
LAC78449-01	8-Fluoroquinolin-3-ol
SWB05603-01	6-Fluoroquinolin-3-ol
JBD31185-01	5-Fluoroquinolin-8-ol hydrobromide
DWB75816-01	(5-Fluoroquinolin-8-yl) methanol
HCC24033-01	(8-Fluoroquinolin-3-yl) methanol