2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene

C8H4F12O3 — CID 58695024

IUPAC2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene
SMILESC=C(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OCF
InChIInChI=1S/C8H4F12O3/c1-3(10)4(11,12)22-7(17,18)8(19,20)23-6(15,16)5(13,14)21-2-9/h1-2H2
InChIKeyNXGUYGVJPCOWQS-UHFFFAOYSA-N
MW376.09 g/mol
LogP4.41
Rot. Bonds9

About 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene

2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene (PubChem CID 58695024) has the molecular formula C8H4F12O3 and a molecular weight of 376.09 g/mol. Its IUPAC name is 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene.

Molecular Properties

Compound Name2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene
PubChem CID58695024
Molecular FormulaC8H4F12O3
Molecular Weight376.09 g/mol
Exact Mass376.00
IUPAC Name2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene
SMILESC=C(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OCF
InChIInChI=1S/C8H4F12O3/c1-3(10)4(11,12)22-7(17,18)8(19,20)23-6(15,16)5(13,14)21-2-9/h1-2H2
InChIKeyNXGUYGVJPCOWQS-UHFFFAOYSA-N
XLogP4.41
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.09
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene?
The IUPAC name of 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene (CID 58695024) is 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene.
What is the SMILES notation for 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene?
The canonical SMILES for 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene is C=C(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)OCF.
What is the InChIKey of 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene?
The InChIKey is NXGUYGVJPCOWQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F12O3/c1-3(10)4(11,12)22-7(17,18)8(19,20)23-6(15,16)5(13,14)21-2-9/h1-2H2.
What are the key properties of 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene?
2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene has a molecular weight of 376.09 g/mol, XLogP of 4.41, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trifluoro-3-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(fluoromethoxy)ethoxy]ethoxy]prop-1-ene is sourced from PubChem (CID 58695024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).