1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane

C11H18F6O — CID 118258370

IUPAC1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane
SMILESCCC(C)(OC(C)(F)C(F)(F)F)C(C)(C)C(F)F
InChIInChI=1S/C11H18F6O/c1-6-9(4,8(2,3)7(12)13)18-10(5,14)11(15,16)17/h7H,6H2,1-5H3
InChIKeyGZAUKKLJGOHTIZ-UHFFFAOYSA-N
MW280.25 g/mol
LogP4.71
Rot. Bonds5

About 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane

1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane (PubChem CID 118258370) has the molecular formula C11H18F6O and a molecular weight of 280.25 g/mol. Its IUPAC name is 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane.

Molecular Properties

Compound Name1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane
PubChem CID118258370
Molecular FormulaC11H18F6O
Molecular Weight280.25 g/mol
Exact Mass280.13
IUPAC Name1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane
SMILESCCC(C)(OC(C)(F)C(F)(F)F)C(C)(C)C(F)F
InChIInChI=1S/C11H18F6O/c1-6-9(4,8(2,3)7(12)13)18-10(5,14)11(15,16)17/h7H,6H2,1-5H3
InChIKeyGZAUKKLJGOHTIZ-UHFFFAOYSA-N
XLogP4.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.25
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane?
The IUPAC name of 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane (CID 118258370) is 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane.
What is the SMILES notation for 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane?
The canonical SMILES for 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane is CCC(C)(OC(C)(F)C(F)(F)F)C(C)(C)C(F)F.
What is the InChIKey of 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane?
The InChIKey is GZAUKKLJGOHTIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F6O/c1-6-9(4,8(2,3)7(12)13)18-10(5,14)11(15,16)17/h7H,6H2,1-5H3.
What are the key properties of 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane?
1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane has a molecular weight of 280.25 g/mol, XLogP of 4.71, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-2,2,3-trimethyl-3-(1,1,1,2-tetrafluoropropan-2-yloxy)pentane is sourced from PubChem (CID 118258370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).