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3-ethoxy-2-fluoro-4-iodopyridine

CAT: 0127-PC1013037-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-PC1013037-01Size:250 mg
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CAS Number
1804432-82-3
MDL Number
MFCD28795535
Purity
95%
Smiles
C1cnc (c (c1I) OCC) F

Chemical Information

3-Ethoxy-2-fluoro-4-iodopyridine
CAS Number1804432-82-3
PubChem CID131078697
IUPAC Name3-ethoxy-2-fluoro-4-iodopyridine
Molecular FormulaC7H7FINO
Molecular Weight267.04
XLogP2.3
Topological Polar Surface Area22.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity125
SMILES
CCOC1=C(C=CN=C1F)I
InChI
InChI=1S/C7H7FINO/c1-2-11-6-5(9)3-4-10-7(6)8/h3-4H,2H2,1H3
InChIKey
RKWWNBCGBCTCOX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Ethoxy-2-fluoro-4-iodopyridine
CAS: 1804432-82-3
CID: 131078697
Formula: C7H7FINO
MW: 267.04
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight267.04
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass266.95564
Monoisotopic Mass266.95564
Topological Polar Surface Area22.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity125
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