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8-Fluoroquinolin-2-amine

CAT: 0127-PC201122-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-PC201122-01Size:100 mg
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CAS Number
1342095-20-8
MDL Number
MFCD19678631
Purity
95%
Smiles
Nc1ccc2cccc(F)c2n1

Chemical Information

8-Fluoroquinolin-2-amine
CAS Number1342095-20-8
PubChem CID64208291
IUPAC Name8-fluoroquinolin-2-amine
Molecular FormulaC9H7FN2
Molecular Weight162.16
XLogP1.9
Topological Polar Surface Area38.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity163
SMILES
C1=CC2=C(C(=C1)F)N=C(C=C2)N
InChI
InChI=1S/C9H7FN2/c10-7-3-1-2-6-4-5-8(11)12-9(6)7/h1-5H,(H2,11,12)
InChIKey
ACADMXUUZZORGE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 8-Fluoroquinolin-2-amine
CAS: 1342095-20-8
CID: 64208291
Formula: C9H7FN2
MW: 162.16
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight162.16
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass162.05932639
Monoisotopic Mass162.05932639
Topological Polar Surface Area38.9 Ų
Heavy Atom Count12
Formal Charge0
Complexity163
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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