chempirical

1,1,2,3,3,3-Hexafluoropropyl chlorofluoromethyl ether

C4H2ClF7OCAS 56860-86-7234.50 g/mol

Open in Covalent MOL file
OFClFFFFFF
Alkyl halideEther

Properties

Molecular formula
C4H2ClF7O
Molar mass
234.50 g/mol
Exact mass
233.9682 Da
logP
2.99Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
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
56860-86-7
SMILES
C(C(OC(F)Cl)(F)F)(C(F)(F)F)F
InChIKey
GPRYVSOUOYKCHJ-UHFFFAOYSA-N
InChI
InChI=1S/C4H2ClF7O/c5-2(7)13-4(11,12)1(6)3(8,9)10/h1-2H

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Work with 1,1,2,3,3,3-Hexafluoropropyl chlorofluoromethyl 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-(Dichloromethoxy)-1,1,2,3,3,3-hexafluoropropane56860-82-367 % similar Difluoromethyl 2H-perfluoropropyl ether56860-85-659 % similar 1,1,1,2,3,3-Hexafluoro-3-(trichloromethoxy)propane56860-83-450 % similar 1,1,2,3,3,3-Hexafluoropropyl methyl ether382-34-348 % similar Ethyl 1,1,2,3,3,3-hexafluoropropyl ether380-34-745 % similar 1,1,1,2,3,3,3-Heptafluoropropane431-89-042 % similar 3-(1,1,2,3,3,3-Hexafluoropropoxy)-1-propene59158-81-540 % similar Enflurane13838-16-934 % similar

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

Elsewhere

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