trifluoro(fluoromethoxymethoxy)methane

C3H4F4O2 — CID 20650242

IUPACtrifluoro(fluoromethoxymethoxy)methane
SMILESFCOCOC(F)(F)F
InChIInChI=1S/C3H4F4O2/c4-1-8-2-9-3(5,6)7/h1-2H2
InChIKeyXIDCQRSVMZRMOF-UHFFFAOYSA-N
MW148.05 g/mol
LogP1.42
Rot. Bonds3

About trifluoro(fluoromethoxymethoxy)methane

trifluoro(fluoromethoxymethoxy)methane (PubChem CID 20650242) has the molecular formula C3H4F4O2 and a molecular weight of 148.05 g/mol. Its IUPAC name is trifluoro(fluoromethoxymethoxy)methane.

Molecular Properties

Compound Nametrifluoro(fluoromethoxymethoxy)methane
PubChem CID20650242
Molecular FormulaC3H4F4O2
Molecular Weight148.05 g/mol
Exact Mass148.01
IUPAC Nametrifluoro(fluoromethoxymethoxy)methane
SMILESFCOCOC(F)(F)F
InChIInChI=1S/C3H4F4O2/c4-1-8-2-9-3(5,6)7/h1-2H2
InChIKeyXIDCQRSVMZRMOF-UHFFFAOYSA-N
XLogP1.42
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.05
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trifluoro(fluoromethoxymethoxy)methane?
The IUPAC name of trifluoro(fluoromethoxymethoxy)methane (CID 20650242) is trifluoro(fluoromethoxymethoxy)methane.
What is the SMILES notation for trifluoro(fluoromethoxymethoxy)methane?
The canonical SMILES for trifluoro(fluoromethoxymethoxy)methane is FCOCOC(F)(F)F.
What is the InChIKey of trifluoro(fluoromethoxymethoxy)methane?
The InChIKey is XIDCQRSVMZRMOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4F4O2/c4-1-8-2-9-3(5,6)7/h1-2H2.
What are the key properties of trifluoro(fluoromethoxymethoxy)methane?
trifluoro(fluoromethoxymethoxy)methane has a molecular weight of 148.05 g/mol, XLogP of 1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro(fluoromethoxymethoxy)methane is sourced from PubChem (CID 20650242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).