1-(1,3-difluoropropan-2-yloxy)-2-methylpropane

C7H14F2O — CID 91071760

IUPAC1-(1,3-difluoropropan-2-yloxy)-2-methylpropane
SMILESCC(C)COC(CF)CF
InChIInChI=1S/C7H14F2O/c1-6(2)5-10-7(3-8)4-9/h6-7H,3-5H2,1-2H3
InChIKeyAAZGGIRKDGYBFT-UHFFFAOYSA-N
MW152.18 g/mol
LogP1.97
Rot. Bonds5

About 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane

1-(1,3-difluoropropan-2-yloxy)-2-methylpropane (PubChem CID 91071760) has the molecular formula C7H14F2O and a molecular weight of 152.18 g/mol. Its IUPAC name is 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane.

Molecular Properties

Compound Name1-(1,3-difluoropropan-2-yloxy)-2-methylpropane
PubChem CID91071760
Molecular FormulaC7H14F2O
Molecular Weight152.18 g/mol
Exact Mass152.10
IUPAC Name1-(1,3-difluoropropan-2-yloxy)-2-methylpropane
SMILESCC(C)COC(CF)CF
InChIInChI=1S/C7H14F2O/c1-6(2)5-10-7(3-8)4-9/h6-7H,3-5H2,1-2H3
InChIKeyAAZGGIRKDGYBFT-UHFFFAOYSA-N
XLogP1.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.18
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane?
The IUPAC name of 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane (CID 91071760) is 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane.
What is the SMILES notation for 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane?
The canonical SMILES for 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane is CC(C)COC(CF)CF.
What is the InChIKey of 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane?
The InChIKey is AAZGGIRKDGYBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F2O/c1-6(2)5-10-7(3-8)4-9/h6-7H,3-5H2,1-2H3.
What are the key properties of 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane?
1-(1,3-difluoropropan-2-yloxy)-2-methylpropane has a molecular weight of 152.18 g/mol, XLogP of 1.97, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-difluoropropan-2-yloxy)-2-methylpropane is sourced from PubChem (CID 91071760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).