1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane

C8H14F4O — CID 22731637

IUPAC1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane
SMILESCC(C)C(F)(F)OC(F)(F)C(C)C
InChIInChI=1S/C8H14F4O/c1-5(2)7(9,10)13-8(11,12)6(3)4/h5-6H,1-4H3
InChIKeyZCEKTBREIHERSP-UHFFFAOYSA-N
MW202.19 g/mol
LogP3.50
Rot. Bonds4

About 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane

1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane (PubChem CID 22731637) has the molecular formula C8H14F4O and a molecular weight of 202.19 g/mol. Its IUPAC name is 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane.

Molecular Properties

Compound Name1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane
PubChem CID22731637
Molecular FormulaC8H14F4O
Molecular Weight202.19 g/mol
Exact Mass202.10
IUPAC Name1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane
SMILESCC(C)C(F)(F)OC(F)(F)C(C)C
InChIInChI=1S/C8H14F4O/c1-5(2)7(9,10)13-8(11,12)6(3)4/h5-6H,1-4H3
InChIKeyZCEKTBREIHERSP-UHFFFAOYSA-N
XLogP3.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.19
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 90992962
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CID 12951110
1,1,1,2-Tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane
CID 18913766
1,1,1-Trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane
CID 19087430
2-[Difluoro-[1,1,3,3,3-pentafluoro-2-methyl-2-(trifluoromethyl)propoxy]methyl]-1,1,1,3,3,3-hexafluoro-2-methylpropane
CID 21549408
2-(Difluoromethyl)-1,1,1,2,3,3-hexafluoro-3-(2-methylpropoxy)propane
CID 22137191
1-(1,1-Difluoro-3-methylbutoxy)-1,1-difluoro-3-methylbutane
CID 22731629
1,1,3-Trifluoro-2-methyl-1-(2,2,2-trifluoroethoxy)propane
CID 22894525
2-Methyl-1-(1,1,2,2-tetrafluoroethoxy)propane
CID 53401061
1,1,2-Trifluoro-1-(1,1,2-trifluoropropoxy)propane
CID 54393034
1,1,2,2,3-Pentafluoro-1-(1,1,2,2,3-pentafluorobutoxy)butane
CID 54525706

Frequently Asked Questions

What is the IUPAC name of 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane?
The IUPAC name of 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane (CID 22731637) is 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane.
What is the SMILES notation for 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane?
The canonical SMILES for 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane is CC(C)C(F)(F)OC(F)(F)C(C)C.
What is the InChIKey of 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane?
The InChIKey is ZCEKTBREIHERSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F4O/c1-5(2)7(9,10)13-8(11,12)6(3)4/h5-6H,1-4H3.
What are the key properties of 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane?
1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane has a molecular weight of 202.19 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1-difluoro-2-methylpropoxy)-1,1-difluoro-2-methylpropane is sourced from PubChem (CID 22731637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).