1,1-difluoro-1-methoxy-2-methylpropane;methanol

C6H14F2O2 — CID 54358777

IUPAC1,1-difluoro-1-methoxy-2-methylpropane;methanol
SMILESCO.COC(F)(F)C(C)C
InChIInChI=1S/C5H10F2O.CH4O/c1-4(2)5(6,7)8-3;1-2/h4H,1-3H3;2H,1H3
InChIKeyUKZNYANLVDULOO-UHFFFAOYSA-N
MW156.17 g/mol
LogP1.49
Rot. Bonds2

About 1,1-difluoro-1-methoxy-2-methylpropane;methanol

1,1-difluoro-1-methoxy-2-methylpropane;methanol (PubChem CID 54358777) has the molecular formula C6H14F2O2 and a molecular weight of 156.17 g/mol. Its IUPAC name is 1,1-difluoro-1-methoxy-2-methylpropane;methanol.

Molecular Properties

Compound Name1,1-difluoro-1-methoxy-2-methylpropane;methanol
PubChem CID54358777
Molecular FormulaC6H14F2O2
Molecular Weight156.17 g/mol
Exact Mass156.10
IUPAC Name1,1-difluoro-1-methoxy-2-methylpropane;methanol
SMILESCO.COC(F)(F)C(C)C
InChIInChI=1S/C5H10F2O.CH4O/c1-4(2)5(6,7)8-3;1-2/h4H,1-3H3;2H,1H3
InChIKeyUKZNYANLVDULOO-UHFFFAOYSA-N
XLogP1.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.17
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-1-methoxy-2-methylpropane;methanol?
The IUPAC name of 1,1-difluoro-1-methoxy-2-methylpropane;methanol (CID 54358777) is 1,1-difluoro-1-methoxy-2-methylpropane;methanol.
What is the SMILES notation for 1,1-difluoro-1-methoxy-2-methylpropane;methanol?
The canonical SMILES for 1,1-difluoro-1-methoxy-2-methylpropane;methanol is CO.COC(F)(F)C(C)C.
What is the InChIKey of 1,1-difluoro-1-methoxy-2-methylpropane;methanol?
The InChIKey is UKZNYANLVDULOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F2O.CH4O/c1-4(2)5(6,7)8-3;1-2/h4H,1-3H3;2H,1H3.
What are the key properties of 1,1-difluoro-1-methoxy-2-methylpropane;methanol?
1,1-difluoro-1-methoxy-2-methylpropane;methanol has a molecular weight of 156.17 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-1-methoxy-2-methylpropane;methanol is sourced from PubChem (CID 54358777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).