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2-Bromo-3- (2-fluoroethoxy) pyridine

CAT: 0127-PC1007573-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-PC1007573-01Size:100 mg
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CAS Number
1352725-59-7
MDL Number
MFCD23970906
Purity
95%
Smiles
FCCOC1=CC=CN=C1Br

Chemical Information

2-Bromo-3-(2-fluoroethoxy)pyridine
CAS Number1352725-59-7
PubChem CID58556856
IUPAC Name2-bromo-3-(2-fluoroethoxy)pyridine
Molecular FormulaC7H7BrFNO
Molecular Weight220.04
XLogP1.7
Topological Polar Surface Area22.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity115
SMILES
C1=CC(=C(N=C1)Br)OCCF
InChI
InChI=1S/C7H7BrFNO/c8-7-6(11-5-3-9)2-1-4-10-7/h1-2,4H,3,5H2
InChIKey
JIGVGJWRCLOING-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Bromo-3-(2-fluoroethoxy)pyridine
CAS: 1352725-59-7
CID: 58556856
Formula: C7H7BrFNO
MW: 220.04
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight220.04
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass218.96950
Monoisotopic Mass218.96950
Topological Polar Surface Area22.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity115
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