4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane

C9H10F8 — CID 20645196

IUPAC4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane
SMILESCCC1CC(F)(C(F)(F)F)C(F)(F)C1(F)CF
InChIInChI=1S/C9H10F8/c1-2-5-3-7(12,9(15,16)17)8(13,14)6(5,11)4-10/h5H,2-4H2,1H3
InChIKeyLBBHXIXRCQNZHX-UHFFFAOYSA-N
MW270.16 g/mol
LogP4.00
Rot. Bonds2

About 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane

4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane (PubChem CID 20645196) has the molecular formula C9H10F8 and a molecular weight of 270.16 g/mol. Its IUPAC name is 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane.

Molecular Properties

Compound Name4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane
PubChem CID20645196
Molecular FormulaC9H10F8
Molecular Weight270.16 g/mol
Exact Mass270.07
IUPAC Name4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane
SMILESCCC1CC(F)(C(F)(F)F)C(F)(F)C1(F)CF
InChIInChI=1S/C9H10F8/c1-2-5-3-7(12,9(15,16)17)8(13,14)6(5,11)4-10/h5H,2-4H2,1H3
InChIKeyLBBHXIXRCQNZHX-UHFFFAOYSA-N
XLogP4.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane?
The IUPAC name of 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane (CID 20645196) is 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane.
What is the SMILES notation for 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane?
The canonical SMILES for 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane is CCC1CC(F)(C(F)(F)F)C(F)(F)C1(F)CF.
What is the InChIKey of 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane?
The InChIKey is LBBHXIXRCQNZHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F8/c1-2-5-3-7(12,9(15,16)17)8(13,14)6(5,11)4-10/h5H,2-4H2,1H3.
What are the key properties of 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane?
4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane has a molecular weight of 270.16 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,2,2,3-tetrafluoro-3-(fluoromethyl)-1-(trifluoromethyl)cyclopentane is sourced from PubChem (CID 20645196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).