1,1-difluoroethoxymethylcyclopropane

C6H10F2O — CID 90392464

IUPAC1,1-difluoroethoxymethylcyclopropane
SMILESCC(F)(F)OCC1CC1
InChIInChI=1S/C6H10F2O/c1-6(7,8)9-4-5-2-3-5/h5H,2-4H2,1H3
InChIKeyKKJSTRNBGRSSFQ-UHFFFAOYSA-N
MW136.14 g/mol
LogP2.03
Rot. Bonds3

About 1,1-difluoroethoxymethylcyclopropane

1,1-difluoroethoxymethylcyclopropane (PubChem CID 90392464) has the molecular formula C6H10F2O and a molecular weight of 136.14 g/mol. Its IUPAC name is 1,1-difluoroethoxymethylcyclopropane.

Molecular Properties

Compound Name1,1-difluoroethoxymethylcyclopropane
PubChem CID90392464
Molecular FormulaC6H10F2O
Molecular Weight136.14 g/mol
Exact Mass136.07
IUPAC Name1,1-difluoroethoxymethylcyclopropane
SMILESCC(F)(F)OCC1CC1
InChIInChI=1S/C6H10F2O/c1-6(7,8)9-4-5-2-3-5/h5H,2-4H2,1H3
InChIKeyKKJSTRNBGRSSFQ-UHFFFAOYSA-N
XLogP2.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.14
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoroethoxymethylcyclopropane?
The IUPAC name of 1,1-difluoroethoxymethylcyclopropane (CID 90392464) is 1,1-difluoroethoxymethylcyclopropane.
What is the SMILES notation for 1,1-difluoroethoxymethylcyclopropane?
The canonical SMILES for 1,1-difluoroethoxymethylcyclopropane is CC(F)(F)OCC1CC1.
What is the InChIKey of 1,1-difluoroethoxymethylcyclopropane?
The InChIKey is KKJSTRNBGRSSFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O/c1-6(7,8)9-4-5-2-3-5/h5H,2-4H2,1H3.
What are the key properties of 1,1-difluoroethoxymethylcyclopropane?
1,1-difluoroethoxymethylcyclopropane has a molecular weight of 136.14 g/mol, XLogP of 2.03, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoroethoxymethylcyclopropane is sourced from PubChem (CID 90392464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).