1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane

C10H14F6O — CID 87660564

IUPAC1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane
SMILESCCC1(OC(C(F)(F)F)C(F)(F)F)CCCC1
InChIInChI=1S/C10H14F6O/c1-2-8(5-3-4-6-8)17-7(9(11,12)13)10(14,15)16/h7H,2-6H2,1H3
InChIKeyPULCBYJNNITGAP-UHFFFAOYSA-N
MW264.21 g/mol
LogP4.22
Rot. Bonds3

About 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane

1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane (PubChem CID 87660564) has the molecular formula C10H14F6O and a molecular weight of 264.21 g/mol. Its IUPAC name is 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane.

Molecular Properties

Compound Name1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane
PubChem CID87660564
Molecular FormulaC10H14F6O
Molecular Weight264.21 g/mol
Exact Mass264.09
IUPAC Name1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane
SMILESCCC1(OC(C(F)(F)F)C(F)(F)F)CCCC1
InChIInChI=1S/C10H14F6O/c1-2-8(5-3-4-6-8)17-7(9(11,12)13)10(14,15)16/h7H,2-6H2,1H3
InChIKeyPULCBYJNNITGAP-UHFFFAOYSA-N
XLogP4.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.21
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane?
The IUPAC name of 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane (CID 87660564) is 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane.
What is the SMILES notation for 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane?
The canonical SMILES for 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane is CCC1(OC(C(F)(F)F)C(F)(F)F)CCCC1.
What is the InChIKey of 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane?
The InChIKey is PULCBYJNNITGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F6O/c1-2-8(5-3-4-6-8)17-7(9(11,12)13)10(14,15)16/h7H,2-6H2,1H3.
What are the key properties of 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane?
1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane has a molecular weight of 264.21 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane is sourced from PubChem (CID 87660564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).