1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane

C8H9F7O2 — CID 20802234

IUPAC1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane
SMILESC=C(F)C(F)(F)OCC(F)(F)C(F)(F)OCC
InChIInChI=1S/C8H9F7O2/c1-3-16-8(14,15)6(10,11)4-17-7(12,13)5(2)9/h2-4H2,1H3
InChIKeyHDDKOYDHVCMPAV-UHFFFAOYSA-N
MW270.14 g/mol
LogP3.34
Rot. Bonds7

About 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane

1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane (PubChem CID 20802234) has the molecular formula C8H9F7O2 and a molecular weight of 270.14 g/mol. Its IUPAC name is 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane.

Molecular Properties

Compound Name1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane
PubChem CID20802234
Molecular FormulaC8H9F7O2
Molecular Weight270.14 g/mol
Exact Mass270.05
IUPAC Name1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane
SMILESC=C(F)C(F)(F)OCC(F)(F)C(F)(F)OCC
InChIInChI=1S/C8H9F7O2/c1-3-16-8(14,15)6(10,11)4-17-7(12,13)5(2)9/h2-4H2,1H3
InChIKeyHDDKOYDHVCMPAV-UHFFFAOYSA-N
XLogP3.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.14
LogP ≤ 53.34
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

1,1,2,2,3,3-Hexafluoro-1,3-bis(prop-2-enoxy)propane
CID 14548675
1,1,2,2-Tetrafluoro-1-(2,2,2-trifluoroethoxy)-3-(1,1,2-trifluoroprop-2-enoxy)propane
CID 21052204
1-[2-[Difluoro(1,1,2-trifluoroprop-2-enoxy)methyl]-2,3,3,3-tetrafluoropropoxy]-2-methylbutane
CID 21052206
1,1,1,2-Tetrafluoro-3-(2-methoxyethoxy)-2-(1,1,2-trifluoroprop-2-enoxy)propane
CID 22897551
1-Ethoxy-1,1,2,2,3,3-hexafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane
CID 57838221
1,1,2,2-Tetrafluoro-1-(1-fluoroethenoxy)-3-(1,1,2-trifluoroprop-2-enoxy)propane
CID 57838226
2-[[2-[Difluoro(1,1,2-trifluoroprop-2-enoxy)methyl]-2,3,3,3-tetrafluoropropoxy]methyl]-1,1,1-trifluorobutane
CID 58587215
1,1,2,2-Tetrafluoro-1-[1,1,2,2,3,3-hexafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propoxy]butane
CID 59364920
1,1,2,2-Tetrafluoro-1-(2-fluoroethoxy)-3-(1,1,2-trifluoroprop-2-enoxy)propane
CID 59559041
2,2-Difluoro-1-[1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propoxy]butane
CID 60058115
1,1,2,2-Tetrafluoro-1-(1,2,2,2-tetrafluoroethoxy)-3-(1,1,2-trifluoroprop-2-enoxy)propane
CID 60058116
1,1,2,2,3,3-Hexafluoro-1-(1,1,2-trifluoroethoxy)-3-(1,1,2-trifluoroprop-2-enoxy)propane
CID 60058123

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane?
The IUPAC name of 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane (CID 20802234) is 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane.
What is the SMILES notation for 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane?
The canonical SMILES for 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane is C=C(F)C(F)(F)OCC(F)(F)C(F)(F)OCC.
What is the InChIKey of 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane?
The InChIKey is HDDKOYDHVCMPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F7O2/c1-3-16-8(14,15)6(10,11)4-17-7(12,13)5(2)9/h2-4H2,1H3.
What are the key properties of 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane?
1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane has a molecular weight of 270.14 g/mol, XLogP of 3.34, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-1,1,2,2-tetrafluoro-3-(1,1,2-trifluoroprop-2-enoxy)propane is sourced from PubChem (CID 20802234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).