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Perfluorobutyl Iodide

CAT: 0572-TRC-P286205-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-P286205-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
423-39-2
Synonyms
Perfluoro-n-butyl Iodide;1,1,1,2,2,3,3,4,4-Nonafluoro-4-iodobutane;1-Iodononafluorobutane; 1-Iodoperfluorobutane;4-Iodoperfluorobutane; Nonafluoro-1-iodobutane
Hazard Statement
Not a hazardous substance according to GHS.
Purity
>95% (GC)
Smiles
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)I
Molecular Formula
C4F9I
Molecular Weight
345.93
Shipping Conditions
Room Temperature

Chemical Information

Perfluorobutyl iodide

is a promising alternative to chlorofluorocarbon solvents used in aircraft ground maintenance operations

CAS Number423-39-2
PubChem CID67917
IUPAC Name1,1,1,2,2,3,3,4,4-nonafluoro-4-iodobutane
Molecular FormulaC4F9I
Molecular Weight345.93
XLogP4.1
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity215
SMILES
C(C(C(F)(F)I)(F)F)(C(F)(F)F)(F)F
InChI
InChI=1S/C4F9I/c5-1(6,3(9,10)11)2(7,8)4(12,13)14
InChIKey
PGRFXXCKHGIFSV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Perfluorobutyl iodide
CAS: 423-39-2
CID: 67917
Formula: C4F9I
MW: 345.93
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight345.93
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Exact Mass345.89010
Monoisotopic Mass345.89010
Topological Polar Surface Area0 Ų
Heavy Atom Count14
Formal Charge0
Complexity215
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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