[difluoro(methoxy)methyl]cyclobutane;hydrofluoride

C6H11F3O — CID 160928700

IUPAC[difluoro(methoxy)methyl]cyclobutane;hydrofluoride
SMILESCOC(F)(F)C1CCC1.F
InChIInChI=1S/C6H10F2O.FH/c1-9-6(7,8)5-3-2-4-5;/h5H,2-4H2,1H3;1H
InChIKeySSYYNORCROHRRR-UHFFFAOYSA-N
MW156.15 g/mol
LogP2.18
Rot. Bonds2

About [difluoro(methoxy)methyl]cyclobutane;hydrofluoride

[difluoro(methoxy)methyl]cyclobutane;hydrofluoride (PubChem CID 160928700) has the molecular formula C6H11F3O and a molecular weight of 156.15 g/mol. Its IUPAC name is [difluoro(methoxy)methyl]cyclobutane;hydrofluoride.

Molecular Properties

Compound Name[difluoro(methoxy)methyl]cyclobutane;hydrofluoride
PubChem CID160928700
Molecular FormulaC6H11F3O
Molecular Weight156.15 g/mol
Exact Mass156.08
IUPAC Name[difluoro(methoxy)methyl]cyclobutane;hydrofluoride
SMILESCOC(F)(F)C1CCC1.F
InChIInChI=1S/C6H10F2O.FH/c1-9-6(7,8)5-3-2-4-5;/h5H,2-4H2,1H3;1H
InChIKeySSYYNORCROHRRR-UHFFFAOYSA-N
XLogP2.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.15
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [difluoro(methoxy)methyl]cyclobutane;hydrofluoride?
The IUPAC name of [difluoro(methoxy)methyl]cyclobutane;hydrofluoride (CID 160928700) is [difluoro(methoxy)methyl]cyclobutane;hydrofluoride.
What is the SMILES notation for [difluoro(methoxy)methyl]cyclobutane;hydrofluoride?
The canonical SMILES for [difluoro(methoxy)methyl]cyclobutane;hydrofluoride is COC(F)(F)C1CCC1.F.
What is the InChIKey of [difluoro(methoxy)methyl]cyclobutane;hydrofluoride?
The InChIKey is SSYYNORCROHRRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O.FH/c1-9-6(7,8)5-3-2-4-5;/h5H,2-4H2,1H3;1H.
What are the key properties of [difluoro(methoxy)methyl]cyclobutane;hydrofluoride?
[difluoro(methoxy)methyl]cyclobutane;hydrofluoride has a molecular weight of 156.15 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [difluoro(methoxy)methyl]cyclobutane;hydrofluoride is sourced from PubChem (CID 160928700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).