1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane

C5H3F9O2 — CID 175803873

IUPAC1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane
SMILESFCC(F)OC(F)(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C5H3F9O2/c6-1-2(7)15-5(13,14)16-4(11,12)3(8,9)10/h2H,1H2
InChIKeyUBJOPJHVKZUEST-UHFFFAOYSA-N
MW266.06 g/mol
LogP2.99
Rot. Bonds5

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

1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane (PubChem CID 175803873) has the molecular formula C5H3F9O2 and a molecular weight of 266.06 g/mol. Its IUPAC name is 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane.

Molecular Properties

Compound Name1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane
PubChem CID175803873
Molecular FormulaC5H3F9O2
Molecular Weight266.06 g/mol
Exact Mass266.00
IUPAC Name1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane
SMILESFCC(F)OC(F)(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C5H3F9O2/c6-1-2(7)15-5(13,14)16-4(11,12)3(8,9)10/h2H,1H2
InChIKeyUBJOPJHVKZUEST-UHFFFAOYSA-N
XLogP2.99
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.06
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane?
The IUPAC name of 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane (CID 175803873) is 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane.
What is the SMILES notation for 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane?
The canonical SMILES for 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane is FCC(F)OC(F)(F)OC(F)(F)C(F)(F)F.
What is the InChIKey of 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane?
The InChIKey is UBJOPJHVKZUEST-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3F9O2/c6-1-2(7)15-5(13,14)16-4(11,12)3(8,9)10/h2H,1H2.
What are the key properties of 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane?
1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane has a molecular weight of 266.06 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,2-difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane is sourced from PubChem (CID 175803873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).