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3-Fluoro-1,5-naphthyridine

CAT: 0127-PC1003353-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-PC1003353-01Size:100 mg
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CAS Number
959617-74-4
MDL Number
MFCD20040402
Purity
95%
Smiles
FC1=CC2=NC=CC=C2N=C1

Chemical Information

3-Fluoro-1,5-naphthyridine
CAS Number959617-74-4
PubChem CID53416191
IUPAC Name3-fluoro-1,5-naphthyridine
Molecular FormulaC8H5FN2
Molecular Weight148.14
XLogP1.3
Topological Polar Surface Area25.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity140
SMILES
C1=CC2=C(C=C(C=N2)F)N=C1
InChI
InChI=1S/C8H5FN2/c9-6-4-8-7(11-5-6)2-1-3-10-8/h1-5H
InChIKey
BZQSONYBXCNVHU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Fluoro-1,5-naphthyridine
CAS: 959617-74-4
CID: 53416191
Formula: C8H5FN2
MW: 148.14
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight148.14
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass148.04367633
Monoisotopic Mass148.04367633
Topological Polar Surface Area25.8 Ų
Heavy Atom Count11
Formal Charge0
Complexity140
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