CAS 2043-53-0|1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane|1H,1H,2H,2H-Perfluorodecyl iodide|1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane|2-(Perfluorooctyl)ethy...

General Information

Structure

Molecular Formula

C₁₀H₄F₁₇I

Molecular Mass

574.0160844

Exact Mass

573.90862787

Charge

InChI

InChI=1S/C10H4F17I/c11-3(12,1-2-28)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2

InChIKey

XVKJSLBVVRCOIT-UHFFFAOYSA-N

Canonic Smiles

ICCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric Smiles

FC(C(C(C(C(C(C(C(CCI)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

7.581686

LogD (pH = 7.4)

7.581686

Log P

7.581686

Molar Refractivity

62.1224

Polarizability

24.732702

Polar Surface Area

0.0

Rotatable Bonds

Lipinski's Rule of Five

false

Data Source

Names and Identifiers

IUPAC Traditional name

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane

Synonyms

1H,1H,2H,2H-Perfluorodecyl iodide2-(Perfluorooctyl)ethyl iodide1-Iodo-1H,1H,2H,2H-perfluorodecane1H,1H,2H,2H-Perfluorodecyl iodide 97%1-碘-1H,1H,2H,2H-全氟癸烷1-碘-1H,1H,2H,2H-全氟癸烷1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-十七氟-10-碘癸烷1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane1H,1H,2H,2H-Perfluoro-1-decyl iodide1-Iodo-1H,1H,2H,2H-perfluorodecane1H,1H,2H,2H-全氟癸基碘烷1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-十七氟-10-碘癸烷1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane1H,1H,2H,2H-Perfluoro-1-iododecane

IUPAC name

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane

Names and Identifiers

Registration numbers

EC Number

218-053-5

CAS Number

2043-53-0

MDL Number

MFCD00039411

PubChem SID

2488734816097056724863073