2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane

C8H16F2O — CID 18938561

IUPAC2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane
SMILESCC(C)(F)COCC(C)(C)F
InChIInChI=1S/C8H16F2O/c1-7(2,9)5-11-6-8(3,4)10/h5-6H2,1-4H3
InChIKeyROZYOWKFMLVZSL-UHFFFAOYSA-N
MW166.21 g/mol
LogP2.50
Rot. Bonds4

About 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane

2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane (PubChem CID 18938561) has the molecular formula C8H16F2O and a molecular weight of 166.21 g/mol. Its IUPAC name is 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane.

Molecular Properties

Compound Name2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane
PubChem CID18938561
Molecular FormulaC8H16F2O
Molecular Weight166.21 g/mol
Exact Mass166.12
IUPAC Name2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane
SMILESCC(C)(F)COCC(C)(C)F
InChIInChI=1S/C8H16F2O/c1-7(2,9)5-11-6-8(3,4)10/h5-6H2,1-4H3
InChIKeyROZYOWKFMLVZSL-UHFFFAOYSA-N
XLogP2.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.21
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane?
The IUPAC name of 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane (CID 18938561) is 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane.
What is the SMILES notation for 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane?
The canonical SMILES for 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane is CC(C)(F)COCC(C)(C)F.
What is the InChIKey of 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane?
The InChIKey is ROZYOWKFMLVZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2O/c1-7(2,9)5-11-6-8(3,4)10/h5-6H2,1-4H3.
What are the key properties of 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane?
2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane has a molecular weight of 166.21 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-(2-fluoro-2-methylpropoxy)-2-methylpropane is sourced from PubChem (CID 18938561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).