2-fluoro-2-(fluoromethoxy)propane

C4H8F2O — CID 118334581

IUPAC2-fluoro-2-(fluoromethoxy)propane
SMILESCC(C)(F)OCF
InChIInChI=1S/C4H8F2O/c1-4(2,6)7-3-5/h3H2,1-2H3
InChIKeyAPOKLTAVOOPZHO-UHFFFAOYSA-N
MW110.10 g/mol
LogP1.64
Rot. Bonds2

About 2-fluoro-2-(fluoromethoxy)propane

2-fluoro-2-(fluoromethoxy)propane (PubChem CID 118334581) has the molecular formula C4H8F2O and a molecular weight of 110.10 g/mol. Its IUPAC name is 2-fluoro-2-(fluoromethoxy)propane.

Molecular Properties

Compound Name2-fluoro-2-(fluoromethoxy)propane
PubChem CID118334581
Molecular FormulaC4H8F2O
Molecular Weight110.10 g/mol
Exact Mass110.05
IUPAC Name2-fluoro-2-(fluoromethoxy)propane
SMILESCC(C)(F)OCF
InChIInChI=1S/C4H8F2O/c1-4(2,6)7-3-5/h3H2,1-2H3
InChIKeyAPOKLTAVOOPZHO-UHFFFAOYSA-N
XLogP1.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.10
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(fluoromethoxy)propane?
The IUPAC name of 2-fluoro-2-(fluoromethoxy)propane (CID 118334581) is 2-fluoro-2-(fluoromethoxy)propane.
What is the SMILES notation for 2-fluoro-2-(fluoromethoxy)propane?
The canonical SMILES for 2-fluoro-2-(fluoromethoxy)propane is CC(C)(F)OCF.
What is the InChIKey of 2-fluoro-2-(fluoromethoxy)propane?
The InChIKey is APOKLTAVOOPZHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F2O/c1-4(2,6)7-3-5/h3H2,1-2H3.
What are the key properties of 2-fluoro-2-(fluoromethoxy)propane?
2-fluoro-2-(fluoromethoxy)propane has a molecular weight of 110.10 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(fluoromethoxy)propane is sourced from PubChem (CID 118334581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).