1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane

C5H5F7O — CID 58114498

IUPAC1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane
SMILESFC(F)COC(F)(F)CC(F)(F)F
InChIInChI=1S/C5H5F7O/c6-3(7)1-13-5(11,12)2-4(8,9)10/h3H,1-2H2
InChIKeyFBCWFKCMMZAEQY-UHFFFAOYSA-N
MW214.08 g/mol
LogP2.81
Rot. Bonds4

About 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane

1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane (PubChem CID 58114498) has the molecular formula C5H5F7O and a molecular weight of 214.08 g/mol. Its IUPAC name is 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane.

Molecular Properties

Compound Name1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane
PubChem CID58114498
Molecular FormulaC5H5F7O
Molecular Weight214.08 g/mol
Exact Mass214.02
IUPAC Name1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane
SMILESFC(F)COC(F)(F)CC(F)(F)F
InChIInChI=1S/C5H5F7O/c6-3(7)1-13-5(11,12)2-4(8,9)10/h3H,1-2H2
InChIKeyFBCWFKCMMZAEQY-UHFFFAOYSA-N
XLogP2.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.08
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1,1,3,3,3-pentafluoropropoxy)propan-2-ol
CID 175353311
1,1,1,3,3-pentafluoro-3-(fluoromethoxy)propane
CID 58114569
1-(difluoromethoxy)-1,1,3,3,3-pentafluoropropane
CID 87502285
1,1,1-trifluoro-4-(1,1,3,3,3-pentafluoropropoxy)butane
CID 88558628
1,1,3,3,3-pentafluoropropyl hypofluorite
CID 22094285
1,1,1,2,3,3-hexafluoro-3-(1,1,3,3,3-pentafluoropropoxy)propane
CID 175373278
1,1,1,3,3,3-hexafluoro-2-(1,1,3,3,3-pentafluoropropoxy)propane
CID 11522280
1-(2-ethoxyethoxy)-1,1,3,3,3-pentafluoropropane
CID 126551294
3-(2,2-difluoroethoxy)-1,1,1-trifluoropropane
CID 126707171
1-ethenoxy-1,1,3,3,3-pentafluoropropane
CID 87600810
CID 158264253
CID 158264253
azane;1,1,1,3,3,3-hexafluoropropane
CID 175100137

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane?
The IUPAC name of 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane (CID 58114498) is 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane.
What is the SMILES notation for 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane?
The canonical SMILES for 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane is FC(F)COC(F)(F)CC(F)(F)F.
What is the InChIKey of 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane?
The InChIKey is FBCWFKCMMZAEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F7O/c6-3(7)1-13-5(11,12)2-4(8,9)10/h3H,1-2H2.
What are the key properties of 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane?
1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane has a molecular weight of 214.08 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethoxy)-1,1,3,3,3-pentafluoropropane is sourced from PubChem (CID 58114498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).