1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane

C6H2F12O2 — CID 175740142

IUPAC1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane
SMILESFC(OC(F)(F)C(F)(F)F)C(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C6H2F12O2/c7-1(19-5(15,16)3(9,10)11)2(8)20-6(17,18)4(12,13)14/h1-2H
InChIKeyBMNMLAQWQKRYGG-UHFFFAOYSA-N
MW334.06 g/mol
LogP3.92
Rot. Bonds5

About 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane

1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane (PubChem CID 175740142) has the molecular formula C6H2F12O2 and a molecular weight of 334.06 g/mol. Its IUPAC name is 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane.

Molecular Properties

Compound Name1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane
PubChem CID175740142
Molecular FormulaC6H2F12O2
Molecular Weight334.06 g/mol
Exact Mass333.99
IUPAC Name1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane
SMILESFC(OC(F)(F)C(F)(F)F)C(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C6H2F12O2/c7-1(19-5(15,16)3(9,10)11)2(8)20-6(17,18)4(12,13)14/h1-2H
InChIKeyBMNMLAQWQKRYGG-UHFFFAOYSA-N
XLogP3.92
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.06
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1-(dichloromethoxy)-1,1,2,2,2-pentafluoroethane
CID 20606324
1-fluoro-1-(1,1,2,2,2-pentafluoroethoxy)propane
CID 174963973
1-(2,2-difluoro-1-methoxyethoxy)-1,1,2,2,2-pentafluoroethane
CID 173044414
1,1,1,2,2-pentafluoro-2-(1,2,2-trichloro-2-fluoroethoxy)ethane
CID 131727729
potassium (2R)-1,1,2-trifluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethanesulfonate
CID 141152926
1,1,2,2-tetrafluoro-3-iodo-1-(1,2,2-trifluoroethoxy)propane
CID 170556920
1-chloro-1-(difluoromethoxy)-2,2,2-trifluoro-1-(1,1,2,2,2-pentafluoroethoxy)ethane
CID 150266243
[2-(difluoromethoxy)-1,1,2,3,3,3-hexafluoropropyl] hypofluorite
CID 88556084
1,1,1,2,2-pentafluoro-2-(1,1,2,2,2-pentafluoroethoxyperoxy)ethane
CID 141163022
difluoromethyl 1,1,2,2,2-pentafluoroethyl carbonate
CID 140587327
1-(2-ethylsulfanyl-1,2,2-trifluoroethoxy)-1,1,2,2,3,3,3-heptafluoropropane
CID 163198787
1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane
CID 175196171

Frequently Asked Questions

What is the IUPAC name of 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane?
The IUPAC name of 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane (CID 175740142) is 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane.
What is the SMILES notation for 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane?
The canonical SMILES for 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane is FC(OC(F)(F)C(F)(F)F)C(F)OC(F)(F)C(F)(F)F.
What is the InChIKey of 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane?
The InChIKey is BMNMLAQWQKRYGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F12O2/c7-1(19-5(15,16)3(9,10)11)2(8)20-6(17,18)4(12,13)14/h1-2H.
What are the key properties of 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane?
1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane has a molecular weight of 334.06 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,2-difluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]-1,1,2,2,2-pentafluoroethane is sourced from PubChem (CID 175740142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).