1,2-Dichloro-1,1,2-trifluoro-2-iodoethane
Properties
- Molecular formula
- C2Cl2F3I
- Molar mass
- 278.82 g/mol
- Exact mass
- 277.8374 Da
- Density
- 2.1959 g/mL (at 25 °C)
- Boiling point
- 99 °C
- logP
- 3.12Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the 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
354-61-0SMILES
FC(F)(Cl)C(F)(Cl)IInChIKey
HCUGPHQZDLROAY-UHFFFAOYSA-NInChI
InChI=1S/C2Cl2F3I/c3-1(5,6)2(4,7)8Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
6 names
- Ethane, 1,2-dichloro-1,1,2-trifluoro-2-iodo-
- 1,2-Dichloro-1,2,2-trifluoro-1-iodoethane
- 1,2-Dichloro-1-iodo-1,2,2-trifluoroethane
- 1,2-Dichloro-2-iodo-1,1,2-trifluoroethane
- 1,2-Dichloro-1-iodotrifluoroethane
- 1-Iodo-1,2-dichloro-1,2,2-trifluoroethane
Work with 1,2-Dichloro-1,1,2-trifluoro-2-iodoethane
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-Chloro-2-iodotetrafluoroethane421-78-348 % similar
1,2-Dichlorotetrafluoroethane76-14-247 % similar
1,3-Dichloro-1,1,2,2,3,3-hexafluoropropane662-01-140 % similar
Chloropentafluoroethane76-15-340 % similar
1,10-Dichloroperfluorodecane156186-28-638 % similar
1,8-Dichloroperfluorooctane647-25-638 % similar
1,1,2-Trichloro-1,2,2-trifluoroethane76-13-138 % similar
1-Bromo-2-chloro-1,1,2,2-tetrafluoroethane354-53-035 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.