3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane

C8H10F6O — CID 173379705

IUPAC3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane
SMILESCCC1CCC(F)(F)C1(F)OC(F)(F)F
InChIInChI=1S/C8H10F6O/c1-2-5-3-4-6(9,10)7(5,11)15-8(12,13)14/h5H,2-4H2,1H3
InChIKeyGNTLSMOYMXRJQI-UHFFFAOYSA-N
MW236.15 g/mol
LogP3.64
Rot. Bonds2

About 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane

3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane (PubChem CID 173379705) has the molecular formula C8H10F6O and a molecular weight of 236.15 g/mol. Its IUPAC name is 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane.

Molecular Properties

Compound Name3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane
PubChem CID173379705
Molecular FormulaC8H10F6O
Molecular Weight236.15 g/mol
Exact Mass236.06
IUPAC Name3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane
SMILESCCC1CCC(F)(F)C1(F)OC(F)(F)F
InChIInChI=1S/C8H10F6O/c1-2-5-3-4-6(9,10)7(5,11)15-8(12,13)14/h5H,2-4H2,1H3
InChIKeyGNTLSMOYMXRJQI-UHFFFAOYSA-N
XLogP3.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.15
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane?
The IUPAC name of 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane (CID 173379705) is 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane.
What is the SMILES notation for 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane?
The canonical SMILES for 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane is CCC1CCC(F)(F)C1(F)OC(F)(F)F.
What is the InChIKey of 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane?
The InChIKey is GNTLSMOYMXRJQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F6O/c1-2-5-3-4-6(9,10)7(5,11)15-8(12,13)14/h5H,2-4H2,1H3.
What are the key properties of 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane?
3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane has a molecular weight of 236.15 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,1,2-trifluoro-2-(trifluoromethoxy)cyclopentane is sourced from PubChem (CID 173379705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).