1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane

C5H5F7O2 — CID 58602209

IUPAC1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane
SMILESCC(F)(F)OC(F)(F)C(F)(F)OCF
InChIInChI=1S/C5H5F7O2/c1-3(7,8)14-5(11,12)4(9,10)13-2-6/h2H2,1H3
InChIKeyIUEDAVSCFBEZPM-UHFFFAOYSA-N
MW230.08 g/mol
LogP2.74
Rot. Bonds5

About 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane

1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane (PubChem CID 58602209) has the molecular formula C5H5F7O2 and a molecular weight of 230.08 g/mol. Its IUPAC name is 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane.

Molecular Properties

Compound Name1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane
PubChem CID58602209
Molecular FormulaC5H5F7O2
Molecular Weight230.08 g/mol
Exact Mass230.02
IUPAC Name1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane
SMILESCC(F)(F)OC(F)(F)C(F)(F)OCF
InChIInChI=1S/C5H5F7O2/c1-3(7,8)14-5(11,12)4(9,10)13-2-6/h2H2,1H3
InChIKeyIUEDAVSCFBEZPM-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.08
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane?
The IUPAC name of 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane (CID 58602209) is 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane.
What is the SMILES notation for 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane?
The canonical SMILES for 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane is CC(F)(F)OC(F)(F)C(F)(F)OCF.
What is the InChIKey of 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane?
The InChIKey is IUEDAVSCFBEZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F7O2/c1-3(7,8)14-5(11,12)4(9,10)13-2-6/h2H2,1H3.
What are the key properties of 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane?
1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane has a molecular weight of 230.08 g/mol, XLogP of 2.74, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethane is sourced from PubChem (CID 58602209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).