[1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane

C10H14F6O — CID 159320339

IUPAC[1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane
SMILESCC(OCC(F)(F)F)(C1CCCC1)C(F)(F)F
InChIInChI=1S/C10H14F6O/c1-8(10(14,15)16,7-4-2-3-5-7)17-6-9(11,12)13/h7H,2-6H2,1H3
InChIKeyLDRHJNMWDFLEHX-UHFFFAOYSA-N
MW264.21 g/mol
LogP4.08
Rot. Bonds3

About [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane

[1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane (PubChem CID 159320339) has the molecular formula C10H14F6O and a molecular weight of 264.21 g/mol. Its IUPAC name is [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane.

Molecular Properties

Compound Name[1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane
PubChem CID159320339
Molecular FormulaC10H14F6O
Molecular Weight264.21 g/mol
Exact Mass264.09
IUPAC Name[1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane
SMILESCC(OCC(F)(F)F)(C1CCCC1)C(F)(F)F
InChIInChI=1S/C10H14F6O/c1-8(10(14,15)16,7-4-2-3-5-7)17-6-9(11,12)13/h7H,2-6H2,1H3
InChIKeyLDRHJNMWDFLEHX-UHFFFAOYSA-N
XLogP4.08
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 ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl)-4-methyloxolane
CID 85267668
3-Methyl-4-(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptyl)oxolane
CID 101115659
3-Methyl-4-(2,2,3,3,4,4,5,5-octafluoropentyl)oxolane
CID 101115660
4,5-Bis(1,1-difluoroethyl)-2,3,3-trifluoro-2-(trifluoromethyl)oxolane
CID 20738948
2,5-Diethyl-3,4-bis(trifluoromethyl)oxolane
CID 20771104
3-[(1,1,1-Trifluoro-2-methylbutan-2-yl)oxymethyl]heptane
CID 59422989
1-Ethyl-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)cyclopentane
CID 87660564
3-Ethyl-4-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononyl)oxolane
CID 89181081
[1,1,1-Trifluoro-3,3-dimethyl-2-(trifluoromethyl)butan-2-yl]oxymethylcyclopentane
CID 118217409
(3R)-2,3-dimethyl-1-(6,6,6-trifluoro-2-methylhexan-2-yl)oxyhexane
CID 134199484
(1,1,1,3,3,3-Hexafluoro-2-methylpropan-2-yl)oxymethylcyclopentane
CID 134373630
6-Fluoro-3-methyl-4-(trifluoromethyl)-3-(3,3,3-trifluoropropoxy)octane
CID 137445671

Frequently Asked Questions

What is the IUPAC name of [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane?
The IUPAC name of [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane (CID 159320339) is [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane.
What is the SMILES notation for [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane?
The canonical SMILES for [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane is CC(OCC(F)(F)F)(C1CCCC1)C(F)(F)F.
What is the InChIKey of [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane?
The InChIKey is LDRHJNMWDFLEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F6O/c1-8(10(14,15)16,7-4-2-3-5-7)17-6-9(11,12)13/h7H,2-6H2,1H3.
What are the key properties of [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane?
[1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane has a molecular weight of 264.21 g/mol, XLogP of 4.08, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1,1,1-trifluoro-2-(2,2,2-trifluoroethoxy)propan-2-yl]cyclopentane is sourced from PubChem (CID 159320339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).