1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane

C8H16F2O — CID 143973782

IUPAC1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane
SMILESCC.COCC1CC(F)(F)C1
InChIInChI=1S/C6H10F2O.C2H6/c1-9-4-5-2-6(7,8)3-5;1-2/h5H,2-4H2,1H3;1-2H3
InChIKeyGSRAUBAVZFAGIM-UHFFFAOYSA-N
MW166.21 g/mol
LogP2.70
Rot. Bonds2

About 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane

1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane (PubChem CID 143973782) has the molecular formula C8H16F2O and a molecular weight of 166.21 g/mol. Its IUPAC name is 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane.

Molecular Properties

Compound Name1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane
PubChem CID143973782
Molecular FormulaC8H16F2O
Molecular Weight166.21 g/mol
Exact Mass166.12
IUPAC Name1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane
SMILESCC.COCC1CC(F)(F)C1
InChIInChI=1S/C6H10F2O.C2H6/c1-9-4-5-2-6(7,8)3-5;1-2/h5H,2-4H2,1H3;1-2H3
InChIKeyGSRAUBAVZFAGIM-UHFFFAOYSA-N
XLogP2.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane?
The IUPAC name of 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane (CID 143973782) is 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane.
What is the SMILES notation for 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane?
The canonical SMILES for 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane is CC.COCC1CC(F)(F)C1.
What is the InChIKey of 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane?
The InChIKey is GSRAUBAVZFAGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O.C2H6/c1-9-4-5-2-6(7,8)3-5;1-2/h5H,2-4H2,1H3;1-2H3.
What are the key properties of 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane?
1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane has a molecular weight of 166.21 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-3-(methoxymethyl)cyclobutane;ethane is sourced from PubChem (CID 143973782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).