1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane

C4HF7O — CID 14150208

IUPAC1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane
SMILESFC(F)=C(F)OC(F)(F)C(F)F
InChIInChI=1S/C4HF7O/c5-1(6)2(7)12-4(10,11)3(8)9/h3H
InChIKeyCNAYXIOTUABDSS-UHFFFAOYSA-N
MW198.04 g/mol
LogP2.90
Rot. Bonds3

About 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane

1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane (PubChem CID 14150208) has the molecular formula C4HF7O and a molecular weight of 198.04 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane
PubChem CID14150208
Molecular FormulaC4HF7O
Molecular Weight198.04 g/mol
Exact Mass197.99
IUPAC Name1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane
SMILESFC(F)=C(F)OC(F)(F)C(F)F
InChIInChI=1S/C4HF7O/c5-1(6)2(7)12-4(10,11)3(8)9/h3H
InChIKeyCNAYXIOTUABDSS-UHFFFAOYSA-N
XLogP2.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.04
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1,1,2,2,3,3-hexafluoro-1-(1,2,2-trifluoroethenoxy)propane
CID 6365941
1-[[[[[[difluoro(1,2,2-trifluoroethenoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,2,2-trifluoroethene
CID 175843113
1-[difluoro(trifluoromethoxy)methoxy]-1,2,2-trifluoroethene
CID 71405026
1,1,2,2-tetrafluoro-4-(1,2,2-trifluoroethenoxy)butane
CID 123447457
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,22,22,23,23,24,24,25,25,26,26,27,27,28,28,29,29,30,30,31,31-trihexacontafluoro-31-(1,2,2-trifluoroethenoxy)hentriacontane
CID 175893093
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-8-(1,2,2-trifluoroethenoxy)octane
CID 19837350
1,1,2,2,3,3,4,4-octafluoro-1-(1,2,2-trifluoroethenoxy)pentane
CID 88551399
1-(2-ethoxy-1,2,2-trifluoroethoxy)-1,1,2,2,3,3,4,4,5,5-decafluoro-5-(1,2,2-trifluoroethenoxy)pentane
CID 175997126
trimethyl(1,1,2,2-tetrafluoroethoxy)silane
CID 174401212
2-(1,2,2-trifluoroethenoxy)propane-2-thiol
CID 155019891
1-[2-[difluoro(1,2,2-trifluoroethenoxy)methoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoro-2-(1,2,2-trifluoroethenoxy)ethane
CID 175691538
1,1,2,3,3,4,4,5,5-nonafluoro-5-(1,2,2-trifluoroethenoxy)pent-1-ene
CID 14496010

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane?
The IUPAC name of 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane (CID 14150208) is 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane.
What is the SMILES notation for 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane?
The canonical SMILES for 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane is FC(F)=C(F)OC(F)(F)C(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane?
The InChIKey is CNAYXIOTUABDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4HF7O/c5-1(6)2(7)12-4(10,11)3(8)9/h3H.
What are the key properties of 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane?
1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane has a molecular weight of 198.04 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoro-1-(1,2,2-trifluoroethenoxy)ethane is sourced from PubChem (CID 14150208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).