1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane

C8H8F10O — CID 57169656

IUPAC1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane
SMILESFCCC(F)(OC(F)(CCF)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H8F10O/c9-3-1-5(11,7(13,14)15)19-6(12,2-4-10)8(16,17)18/h1-4H2
InChIKeyVECWRCDXIZNBCH-UHFFFAOYSA-N
MW310.13 g/mol
LogP4.18
Rot. Bonds6

About 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane

1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane (PubChem CID 57169656) has the molecular formula C8H8F10O and a molecular weight of 310.13 g/mol. Its IUPAC name is 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane.

Molecular Properties

Compound Name1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane
PubChem CID57169656
Molecular FormulaC8H8F10O
Molecular Weight310.13 g/mol
Exact Mass310.04
IUPAC Name1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane
SMILESFCCC(F)(OC(F)(CCF)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H8F10O/c9-3-1-5(11,7(13,14)15)19-6(12,2-4-10)8(16,17)18/h1-4H2
InChIKeyVECWRCDXIZNBCH-UHFFFAOYSA-N
XLogP4.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.13
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Difluoromethyl-1-fluoro-2,2,2-trifluoroethyl ether
CID 21647381
Fluoromethyl-1,1,1,3,3,3-hexafluoro-2-propyl ether
CID 22178431
1,2-Trifluoroethyl-difluoromethyl ether
CID 23120850
Trifluoroethyldifluoromethyl ether
CID 57076582
Difluoro-ethylmethyl ether
CID 59628160
2,2,2-Trifluoroethyl-1,1,2,2-tetrafluoroethyl ether
CID 87337995
2,2,3-Trifluoro-3-(2,3,3-trifluorobutan-2-yloxy)butane
CID 12951110
1,1,1,2,2,3,3-Heptafluoro-3-(1,1,1,2,3,3-hexafluoropropan-2-yloxy)propane
CID 12604749
(CF3)2Cfocf2chf2
CID 12663045
1,1,1,2,3,3,3-Heptafluoro-2-(1,1,2,2,3,3-hexafluoropropoxy)propane
CID 17802544
1,1,1-Trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane
CID 19087430
1,1,1,2,3,4-Hexafluoro-3-(1,1,1,2,3,4-hexafluoropentan-3-yloxy)pentane
CID 20352484

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane?
The IUPAC name of 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane (CID 57169656) is 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane.
What is the SMILES notation for 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane?
The canonical SMILES for 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane is FCCC(F)(OC(F)(CCF)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane?
The InChIKey is VECWRCDXIZNBCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F10O/c9-3-1-5(11,7(13,14)15)19-6(12,2-4-10)8(16,17)18/h1-4H2.
What are the key properties of 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane?
1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane has a molecular weight of 310.13 g/mol, XLogP of 4.18, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,4-pentafluoro-2-(1,1,1,2,4-pentafluorobutan-2-yloxy)butane is sourced from PubChem (CID 57169656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).