1,1,1,2,2,3,3-Heptafluoro-5-iodopentane

C₅H₄F₇ICAS 1513-88-8323.98 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₄F₇I
Molar mass: 323.98 g/mol
Exact mass: 323.9246 Da
logP: 3.64Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

1513-88-8

SMILES

C(CI)C(C(C(F)(F)F)(F)F)(F)F

InChIKey

TZNRRNKRZXHADL-UHFFFAOYSA-N

InChI

InChI=1S/C5H4F7I/c6-3(7,1-2-13)4(8,9)5(10,11)12/h1-2H2

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Names and synonyms

1 names

Alkyl iodides, C4-20, gamma-omega-perfluoro

Work with 1,1,1,2,2,3,3-Heptafluoro-5-iodopentane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1,1,2,2,3,3,4,4-Nonafluoro-6-iodohexane2043-55-286 % similar 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane2043-53-083 % similar 1-Iodo-1H,1H,2H,2H-perfluorododecane2043-54-183 % similar 1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluoro-8-iodooctane2043-57-483 % similar 3,3,4,4,5,5,6,6-Octafluoro-1,8-diiodooctane2681-00-776 % similar 1,1,1,2,2-Pentafluoro-4-iodobutane40723-80-668 % similar 1,1,1,2,2,3,3-Heptafluoro-4-iodobutane374-98-158 % similar 3-(Perfluoropropyl)propanol679-02-750 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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