Pentafluoroiodobenzene
Properties
- Molecular formula
- C6F5I
- Molar mass
- 293.96 g/mol
- Exact mass
- 293.8965 Da
- Melting point
- −29 °C
- Boiling point
- 166 °C
- logP
- 2.99Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
827-15-6SMILES
Fc1c(F)c(F)c(I)c(F)c1FInChIKey
OPYHNLNYCRZOGY-UHFFFAOYSA-NInChI
InChI=1S/C6F5I/c7-1-2(8)4(10)6(12)5(11)3(1)9Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzene, 1,2,3,4,5-pentafluoro-6-iodo-
- Benzene, pentafluoroiodo-
- 1,2,3,4,5-Pentafluoro-6-iodobenzene
- Iodopentafluorobenzene
- Iodoperfluorobenzene
- 2,3,4,5,6-Pentafluoroiodobenzene
- Pentafluorophenyl iodide
- Perfluoroiodobenzene
- NSC 88306
Work with Pentafluoroiodobenzene
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
1,4-Diiodotetrafluorobenzene392-57-492 % similar
1,2,3,4-Tetrafluoro-5,6-diiodobenzene2708-97-685 % similar
1,3,5-Trifluoro-2,4,6-triiodobenzene84322-56-577 % similar
Hexafluorobenzene392-56-350 % similar
Octafluoronaphthalene313-72-440 % similar
Decafluorobiphenyl434-90-240 % similar
Bromopentafluorobenzene344-04-735 % similar
1,2-Dibromotetrafluorobenzene827-08-735 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.