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Heptadecafluoro-1-iodooctane

Catalog Number
ACM507631
Product Name
Heptadecafluoro-1-iodooctane
Structure
CAS
507-63-1
Category
Solubility Enhancing Reagents
Description
Liquid
IUPAC Name
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-8-iodooctane
Molecular Weight
545.96g/mol
Molecular Formula
C8F17I
Canonical SMILES
C(C(C(C(C(F)(F)I)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C8F17I/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)26
InChI Key
KWXGJTSJUKTDQU-UHFFFAOYSA-N
Boiling Point
160.5 °C
Melting Point
20.8 °C
Purity
>98.0%(GC)
Complexity
527
Covalently-Bonded Unit Count
1
EC Number
208-079-5
Exact Mass
545.87733g/mol
Formal Charge
0
Hazard Statements
H226
Heavy Atom Count
26
MeSH Entry Terms
AF0144;Imagent BP;Imagent GI;L 1913;L-1913;LA 11063;LA11063;Oxygent;perflubron;perflubron emulsion;perfluoroctylbromide;perfluorooctyl bromide;perfluorooctyl iodide;perfluorooctylbromide;perfluorooctyliodide;PFOB
Monoisotopic Mass
545.87733g/mol
Rotatable Bond Count
6
UNII
072985Y799
XLogP3
6.8
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