1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane

C11H20F4O — CID 89375556

IUPAC1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane
SMILESCC(C)C(C)(C)C(F)(F)OC(C)(C)C(F)F
InChIInChI=1S/C11H20F4O/c1-7(2)9(3,4)11(14,15)16-10(5,6)8(12)13/h7-8H,1-6H3
InChIKeyZAPIOEIATXNTRR-UHFFFAOYSA-N
MW244.27 g/mol
LogP4.32
Rot. Bonds5

About 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane

1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane (PubChem CID 89375556) has the molecular formula C11H20F4O and a molecular weight of 244.27 g/mol. Its IUPAC name is 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane.

Molecular Properties

Compound Name1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane
PubChem CID89375556
Molecular FormulaC11H20F4O
Molecular Weight244.27 g/mol
Exact Mass244.15
IUPAC Name1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane
SMILESCC(C)C(C)(C)C(F)(F)OC(C)(C)C(F)F
InChIInChI=1S/C11H20F4O/c1-7(2)9(3,4)11(14,15)16-10(5,6)8(12)13/h7-8H,1-6H3
InChIKeyZAPIOEIATXNTRR-UHFFFAOYSA-N
XLogP4.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane?
The IUPAC name of 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane (CID 89375556) is 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane.
What is the SMILES notation for 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane?
The canonical SMILES for 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane is CC(C)C(C)(C)C(F)(F)OC(C)(C)C(F)F.
What is the InChIKey of 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane?
The InChIKey is ZAPIOEIATXNTRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F4O/c1-7(2)9(3,4)11(14,15)16-10(5,6)8(12)13/h7-8H,1-6H3.
What are the key properties of 1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane?
1-(1,1-difluoro-2-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane has a molecular weight of 244.27 g/mol, XLogP of 4.32, 5 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-methylpropan-2-yl)oxy-1,1-difluoro-2,2,3-trimethylbutane is sourced from PubChem (CID 89375556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).