1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane

C6H8F6O — CID 58362317

IUPAC1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane
SMILESCC(C)(CF)OC(F)(F)C(F)(F)F
InChIInChI=1S/C6H8F6O/c1-4(2,3-7)13-6(11,12)5(8,9)10/h3H2,1-2H3
InChIKeyYFJFUVBXNAORDS-UHFFFAOYSA-N
MW210.12 g/mol
LogP2.91
Rot. Bonds3

About 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane

1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane (PubChem CID 58362317) has the molecular formula C6H8F6O and a molecular weight of 210.12 g/mol. Its IUPAC name is 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane.

Molecular Properties

Compound Name1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane
PubChem CID58362317
Molecular FormulaC6H8F6O
Molecular Weight210.12 g/mol
Exact Mass210.05
IUPAC Name1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane
SMILESCC(C)(CF)OC(F)(F)C(F)(F)F
InChIInChI=1S/C6H8F6O/c1-4(2,3-7)13-6(11,12)5(8,9)10/h3H2,1-2H3
InChIKeyYFJFUVBXNAORDS-UHFFFAOYSA-N
XLogP2.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.12
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

Fluoromethyl-1,1,1,3,3,3-hexafluoro-2-propyl ether
CID 22178431
Difluoro-ethylmethyl ether
CID 59628160
1,1,1,3,3,3-Hexafluoro-2-methyl-2-propoxypropane
CID 138604548
2,2,3-Trifluoro-3-(2,3,3-trifluorobutan-2-yloxy)butane
CID 12951110
2-Methyl-2-(1,1,2,2-tetrafluoroethoxy)propane
CID 2782467
2-Methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane
CID 10130317
2-(1,1,2,2,3,3,3-Heptafluoropropoxy)-2-methylpropane
CID 10198680
2-Methyl-2-[1,1,2,2-tetrafluoro-2-(trifluoromethoxy)ethoxy]propane
CID 10220766
2-Ethoxy-2-(trifluoromethyl)-1,1,1,3,3,3-hexafluoropropane
CID 11065298
2-Methyl-2-(2,2,2-trifluoroethoxy)propane
CID 13351891
1,1,1,3,3,3-Hexafluoro-2-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)oxy-2-methylpropane
CID 19066587
1,1,1-Trifluoro-2-methyl-2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxypropane
CID 19087430

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane?
The IUPAC name of 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane (CID 58362317) is 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane.
What is the SMILES notation for 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane?
The canonical SMILES for 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane is CC(C)(CF)OC(F)(F)C(F)(F)F.
What is the InChIKey of 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane?
The InChIKey is YFJFUVBXNAORDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F6O/c1-4(2,3-7)13-6(11,12)5(8,9)10/h3H2,1-2H3.
What are the key properties of 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane?
1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane has a molecular weight of 210.12 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-methyl-2-(1,1,2,2,2-pentafluoroethoxy)propane is sourced from PubChem (CID 58362317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).