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2- (3-Fluorophenoxy) -6-chloropyrazine

CAT: 0127-PC430567Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0127-PC430567Size:1 Each
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CAS Number
894416-95-6
MDL Number
MFCD09952090
Purity
=95%
Smiles
Fc1cccc(Oc2cncc(Cl)n2)c1

Chemical Information

2-Chloro-6-(3-fluorophenoxy)pyrazine
CAS Number894416-95-6
PubChem CID53486074
IUPAC Name2-chloro-6-(3-fluorophenoxy)pyrazine
Molecular FormulaC10H6ClFN2O
Molecular Weight224.62
XLogP2.7
Topological Polar Surface Area35
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity208
SMILES
C1=CC(=CC(=C1)F)OC2=CN=CC(=N2)Cl
InChI
InChI=1S/C10H6ClFN2O/c11-9-5-13-6-10(14-9)15-8-3-1-2-7(12)4-8/h1-6H
InChIKey
FIMYUIDWIBADAZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Chloro-6-(3-fluorophenoxy)pyrazine
CAS: 894416-95-6
CID: 53486074
Formula: C10H6ClFN2O
MW: 224.62
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.62
XLogP32.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass224.0152687
Monoisotopic Mass224.0152687
Topological Polar Surface Area35 Ų
Heavy Atom Count15
Formal Charge0
Complexity208
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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