2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane

C7H9F7O — CID 10198680

IUPAC2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane
SMILESCC(C)(C)OC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H9F7O/c1-4(2,3)15-7(13,14)5(8,9)6(10,11)12/h1-3H3
InChIKeyZJAFJAHIHAXUIO-UHFFFAOYSA-N
MW242.13 g/mol
LogP3.59
Rot. Bonds2

About 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane

2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane (PubChem CID 10198680) has the molecular formula C7H9F7O and a molecular weight of 242.13 g/mol. Its IUPAC name is 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane.

Molecular Properties

Compound Name2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane
PubChem CID10198680
Molecular FormulaC7H9F7O
Molecular Weight242.13 g/mol
Exact Mass242.05
IUPAC Name2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane
SMILESCC(C)(C)OC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H9F7O/c1-4(2,3)15-7(13,14)5(8,9)6(10,11)12/h1-3H3
InChIKeyZJAFJAHIHAXUIO-UHFFFAOYSA-N
XLogP3.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.13
LogP ≤ 53.59
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-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
2-(2-Fluoropropan-2-yloxy)-2-methylpropane
CID 20684905

Frequently Asked Questions

What is the IUPAC name of 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane?
The IUPAC name of 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane (CID 10198680) is 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane.
What is the SMILES notation for 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane?
The canonical SMILES for 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane is CC(C)(C)OC(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane?
The InChIKey is ZJAFJAHIHAXUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F7O/c1-4(2,3)15-7(13,14)5(8,9)6(10,11)12/h1-3H3.
What are the key properties of 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane?
2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane has a molecular weight of 242.13 g/mol, XLogP of 3.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,2,2,3,3,3-heptafluoropropoxy)-2-methylpropane is sourced from PubChem (CID 10198680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).