1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane

C8F18O5 — CID 175196171

IUPAC1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane
SMILESFC(F)(OC(F)(F)OC(F)(F)OC(F)(F)C(F)(F)F)OC(F)(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C8F18O5/c9-1(10,11)3(15,16)27-5(19,20)29-7(23,24)31-8(25,26)30-6(21,22)28-4(17,18)2(12,13)14
InChIKeyAVENUFXISSFWDN-UHFFFAOYSA-N
MW518.05 g/mol
LogP5.58
Rot. Bonds10

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

1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane (PubChem CID 175196171) has the molecular formula C8F18O5 and a molecular weight of 518.05 g/mol. Its IUPAC name is 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane.

Molecular Properties

Compound Name1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane
PubChem CID175196171
Molecular FormulaC8F18O5
Molecular Weight518.05 g/mol
Exact Mass517.95
IUPAC Name1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane
SMILESFC(F)(OC(F)(F)OC(F)(F)OC(F)(F)C(F)(F)F)OC(F)(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C8F18O5/c9-1(10,11)3(15,16)27-5(19,20)29-7(23,24)31-8(25,26)30-6(21,22)28-4(17,18)2(12,13)14
InChIKeyAVENUFXISSFWDN-UHFFFAOYSA-N
XLogP5.58
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.05
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1,1,1,2,2,3,3-heptafluoro-3-(1,1,2,2,2-pentafluoroethoxy)propane
CID 10968705
2-[[difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-1,1,2,2-tetrafluoroethanol
CID 58913824
1,1,1,2,2,3,3-heptafluoro-3-(1,1,2,2,2-pentafluoroethoxy)propane;methane
CID 160879773
1,1,1,2,2,3,3,4,4-nonafluoro-4-(1,1,2,2,2-pentafluoroethoxy)butane
CID 11325674
18-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,19,19,19-octatriacontafluoro-N-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-heptatriacontafluorooctadecyl)nonadecan-1-amine
CID 146310584
1,1,1,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)-2-(trifluoromethoxy)ethane
CID 166791480
2-[2-[2-[2-[difluoro-[(2-methylpropan-2-yl)oxy]methoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethoxy]-2-methylpropane
CID 177115998
1-chloro-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluoro-6-(1,1,2,2,2-pentafluoroethoxy)hexane
CID 12829603
2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]ethoxy]ethanol
CID 87104416
1,1,1,2,2-pentafluoro-2-(1,1,2,2,2-pentafluoroethoxyperoxy)ethane
CID 141163022
[2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]acetyl] 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,2-pentafluoroethoxy)ethoxy]ethaneperoxoate
CID 156700386
1,1,1,2,3,3-hexafluoro-3-(1,1,2,2,2-pentafluoroethoxy)-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)propane
CID 155982269

Frequently Asked Questions

What is the IUPAC name of 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane?
The IUPAC name of 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane (CID 175196171) is 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane.
What is the SMILES notation for 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane?
The canonical SMILES for 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane is FC(F)(OC(F)(F)OC(F)(F)OC(F)(F)C(F)(F)F)OC(F)(F)OC(F)(F)C(F)(F)F.
What is the InChIKey of 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane?
The InChIKey is AVENUFXISSFWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8F18O5/c9-1(10,11)3(15,16)27-5(19,20)29-7(23,24)31-8(25,26)30-6(21,22)28-4(17,18)2(12,13)14.
What are the key properties of 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane?
1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane has a molecular weight of 518.05 g/mol, XLogP of 5.58, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane is sourced from PubChem (CID 175196171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).