1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane

C10H14F8O — CID 18913766

IUPAC1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane
SMILESCC(C)C(F)(OC(F)(C(C)C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H14F8O/c1-5(2)7(11,9(13,14)15)19-8(12,6(3)4)10(16,17)18/h5-6H,1-4H3
InChIKeyJZOJMFNVCYKIMJ-UHFFFAOYSA-N
MW302.21 g/mol
LogP4.77
Rot. Bonds4

About 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane

1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane (PubChem CID 18913766) has the molecular formula C10H14F8O and a molecular weight of 302.21 g/mol. Its IUPAC name is 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane.

Molecular Properties

Compound Name1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane
PubChem CID18913766
Molecular FormulaC10H14F8O
Molecular Weight302.21 g/mol
Exact Mass302.09
IUPAC Name1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane
SMILESCC(C)C(F)(OC(F)(C(C)C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H14F8O/c1-5(2)7(11,9(13,14)15)19-8(12,6(3)4)10(16,17)18/h5-6H,1-4H3
InChIKeyJZOJMFNVCYKIMJ-UHFFFAOYSA-N
XLogP4.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.21
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane?
The IUPAC name of 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane (CID 18913766) is 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane.
What is the SMILES notation for 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane?
The canonical SMILES for 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane is CC(C)C(F)(OC(F)(C(C)C)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane?
The InChIKey is JZOJMFNVCYKIMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F8O/c1-5(2)7(11,9(13,14)15)19-8(12,6(3)4)10(16,17)18/h5-6H,1-4H3.
What are the key properties of 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane?
1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane has a molecular weight of 302.21 g/mol, XLogP of 4.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2-tetrafluoro-3-methyl-2-(1,1,1,2-tetrafluoro-3-methylbutan-2-yl)oxybutane is sourced from PubChem (CID 18913766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).