1-(difluoromethoxy)-1-ethylcyclopentane

C8H14F2O — CID 69024555

IUPAC1-(difluoromethoxy)-1-ethylcyclopentane
SMILESCCC1(OC(F)F)CCCC1
InChIInChI=1S/C8H14F2O/c1-2-8(11-7(9)10)5-3-4-6-8/h7H,2-6H2,1H3
InChIKeyKBSZDWBEVASBRK-UHFFFAOYSA-N
MW164.19 g/mol
LogP2.95
Rot. Bonds3

About 1-(difluoromethoxy)-1-ethylcyclopentane

1-(difluoromethoxy)-1-ethylcyclopentane (PubChem CID 69024555) has the molecular formula C8H14F2O and a molecular weight of 164.19 g/mol. Its IUPAC name is 1-(difluoromethoxy)-1-ethylcyclopentane.

Molecular Properties

Compound Name1-(difluoromethoxy)-1-ethylcyclopentane
PubChem CID69024555
Molecular FormulaC8H14F2O
Molecular Weight164.19 g/mol
Exact Mass164.10
IUPAC Name1-(difluoromethoxy)-1-ethylcyclopentane
SMILESCCC1(OC(F)F)CCCC1
InChIInChI=1S/C8H14F2O/c1-2-8(11-7(9)10)5-3-4-6-8/h7H,2-6H2,1H3
InChIKeyKBSZDWBEVASBRK-UHFFFAOYSA-N
XLogP2.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(difluoromethoxy)-1-ethylcyclopentane?
The IUPAC name of 1-(difluoromethoxy)-1-ethylcyclopentane (CID 69024555) is 1-(difluoromethoxy)-1-ethylcyclopentane.
What is the SMILES notation for 1-(difluoromethoxy)-1-ethylcyclopentane?
The canonical SMILES for 1-(difluoromethoxy)-1-ethylcyclopentane is CCC1(OC(F)F)CCCC1.
What is the InChIKey of 1-(difluoromethoxy)-1-ethylcyclopentane?
The InChIKey is KBSZDWBEVASBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2O/c1-2-8(11-7(9)10)5-3-4-6-8/h7H,2-6H2,1H3.
What are the key properties of 1-(difluoromethoxy)-1-ethylcyclopentane?
1-(difluoromethoxy)-1-ethylcyclopentane has a molecular weight of 164.19 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(difluoromethoxy)-1-ethylcyclopentane is sourced from PubChem (CID 69024555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).