2,2,2-Trifluoroethyl difluoromethyl ether
Properties
- Molecular formula
- C3H3F5O
- Molar mass
- 150.05 g/mol
- Exact mass
- 150.0104 Da
- Boiling point
- 29.3 °C
- logP
- 1.79Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1885-48-9SMILES
FC(F)OCC(F)(F)FInChIKey
ZASBKNPRLPFSCA-UHFFFAOYSA-NInChI
InChI=1S/C3H3F5O/c4-2(5)9-1-3(6,7)8/h2H,1H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Ethane, 2-(difluoromethoxy)-1,1,1-trifluoro-
- Ether, difluoromethyl 2,2,2-trifluoroethyl
- 2-(Difluoromethoxy)-1,1,1-trifluoroethane
- Difluoromethyl 2,2,2-trifluoroethyl ether
- HFC-E 245
- R-E 245Fa1
- HFE 245fa2
- HFE 245mf
- E 245
- RE 245
Work with 2,2,2-Trifluoroethyl difluoromethyl ether
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
3-(Difluoromethoxy)-1,1,2,2-tetrafluoropropane35042-99-054 % similar
1,1′-Oxybis[2,2,2-trifluoroethane]333-36-845 % similar
1,1,2,2-Tetrafluoro-1-(2,2,2-trifluoroethoxy)ethane406-78-042 % similar
2,2,2-Trifluoroethyl formate32042-38-940 % similar
2,2,2-Trifluoroethyl methyl ether460-43-539 % similar
Tris(2,2,2-trifluoroethyl) borate659-18-739 % similar
Desflurane57041-67-536 % similar
Pentafluoropropane460-73-135 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.