1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane

C6H9F7O2 — CID 18430296

IUPAC1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane
SMILESCOC.FCOC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C4H3F7O.C2H6O/c5-1-12-2(3(6,7)8)4(9,10)11;1-3-2/h2H,1H2;1-2H3
InChIKeyLLTMOAGHLOYQDG-UHFFFAOYSA-N
MW246.12 g/mol
LogP2.69
Rot. Bonds2

About 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane

1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane (PubChem CID 18430296) has the molecular formula C6H9F7O2 and a molecular weight of 246.12 g/mol. Its IUPAC name is 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane.

Molecular Properties

Compound Name1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane
PubChem CID18430296
Molecular FormulaC6H9F7O2
Molecular Weight246.12 g/mol
Exact Mass246.05
IUPAC Name1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane
SMILESCOC.FCOC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C4H3F7O.C2H6O/c5-1-12-2(3(6,7)8)4(9,10)11;1-3-2/h2H,1H2;1-2H3
InChIKeyLLTMOAGHLOYQDG-UHFFFAOYSA-N
XLogP2.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.12
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Hexafluoroisopropyl methyl ether
CID 25749
Fluoromethyl 2-methoxy-2,2-difluoro-1-(trifluoromethyl)ethyl ether
CID 124367
2-(Difluoromethoxy)-1,1,1-trifluoropropane
CID 22178549
Difluormethyl-ather
CID 10464348
2-(Trifluoromethoxy)propane
CID 21068678
1,1,1-Trifluoro-2-methoxy-propane
CID 22022770
Ethoxyhex a-fluorobutane
CID 53855163
2-Ethoxy-1,1,1-trifluoropropane
CID 53966619
1,1,1-Trifluoro-2,3-dimethoxypropane
CID 153666622
1,1,3-Trifluoro-2-(1,1,3-trifluoropropan-2-yloxy)propane
CID 13640737
2-(2,2,2-Trifluoroethoxy)butane
CID 14024100
2-(Difluoromethoxy)propane
CID 14400534

Frequently Asked Questions

What is the IUPAC name of 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane?
The IUPAC name of 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane (CID 18430296) is 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane.
What is the SMILES notation for 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane?
The canonical SMILES for 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane is COC.FCOC(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane?
The InChIKey is LLTMOAGHLOYQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F7O.C2H6O/c5-1-12-2(3(6,7)8)4(9,10)11;1-3-2/h2H,1H2;1-2H3.
What are the key properties of 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane?
1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane has a molecular weight of 246.12 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,3,3,3-hexafluoro-2-(fluoromethoxy)propane;methoxymethane is sourced from PubChem (CID 18430296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).