2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene

C33H39F27O8 — CID 91395037

IUPAC2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene
SMILESC=COC.C=COCC(F)(F)F.C=COCCCOCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.C=COCCOC(C(F)(F)F)C(F)(F)F.C=COCCOCC(F)(F)F
InChIInChI=1S/C13H11F15O2.C7H8F6O2.C6H9F3O2.C4H5F3O.C3H6O/c1-2-29-4-3-5-30-6-7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)28;1-2-14-3-4-15-5(6(8,9)10)7(11,12)13;1-2-10-3-4-11-5-6(7,8)9;1-2-8-3-4(5,6)7;1-3-4-2/h2H,1,3-6H2;2,5H,1,3-4H2;2H,1,3-5H2;2H,1,3H2;3H,1H2,2H3
InChIKeyHRRYWVHJIDPJIH-UHFFFAOYSA-N
MW1076.61 g/mol
LogP12.79
Rot. Bonds25

About 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene

2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene (PubChem CID 91395037) has the molecular formula C33H39F27O8 and a molecular weight of 1076.61 g/mol. Its IUPAC name is 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene.

Molecular Properties

Compound Name2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene
PubChem CID91395037
Molecular FormulaC33H39F27O8
Molecular Weight1076.61 g/mol
Exact Mass1076.22
IUPAC Name2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene
SMILESC=COC.C=COCC(F)(F)F.C=COCCCOCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.C=COCCOC(C(F)(F)F)C(F)(F)F.C=COCCOCC(F)(F)F
InChIInChI=1S/C13H11F15O2.C7H8F6O2.C6H9F3O2.C4H5F3O.C3H6O/c1-2-29-4-3-5-30-6-7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)28;1-2-14-3-4-15-5(6(8,9)10)7(11,12)13;1-2-10-3-4-11-5-6(7,8)9;1-2-8-3-4(5,6)7;1-3-4-2/h2H,1,3-6H2;2,5H,1,3-4H2;2H,1,3-5H2;2H,1,3H2;3H,1H2,2H3
InChIKeyHRRYWVHJIDPJIH-UHFFFAOYSA-N
XLogP12.79
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds25
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001076.61
LogP ≤ 512.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene with MolForge

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Related Compounds

1,1,1,2,2,3,3,4,4-nonafluoro-5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pentane
CID 102378165
5-ethenoxy-1,1,1,2,2,3,3,4,4-nonafluoropentane
CID 57443666
9-(2-ethenoxyethoxy)-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluorononane
CID 102450340
1-(2,2,3,3,4,4,4-heptafluorobutoxy)-10-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]decane
CID 126609131
1-(2-ethenoxyethoxy)-3-methoxypropane
CID 103177352
1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-7-prop-2-enoxyheptane
CID 102243922
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-nonadecafluoro-10-prop-2-enoxydecane
CID 102243921
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-9-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-propoxypropoxy]nonane
CID 129013089
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-11-[2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propoxy]undecane
CID 11115003
1,1,1,2,2,3,3,4,4,5,5-undecafluoro-6-methoxyhexane
CID 71669115
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoro-8-methoxyoctane
CID 21057502
1,3-bis(2,2,2-trifluoroethoxy)propane
CID 57255720

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene?
The IUPAC name of 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene (CID 91395037) is 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene.
What is the SMILES notation for 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene?
The canonical SMILES for 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene is C=COC.C=COCC(F)(F)F.C=COCCCOCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.C=COCCOC(C(F)(F)F)C(F)(F)F.C=COCCOCC(F)(F)F.
What is the InChIKey of 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene?
The InChIKey is HRRYWVHJIDPJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F15O2.C7H8F6O2.C6H9F3O2.C4H5F3O.C3H6O/c1-2-29-4-3-5-30-6-7(14,15)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)28;1-2-14-3-4-15-5(6(8,9)10)7(11,12)13;1-2-10-3-4-11-5-6(7,8)9;1-2-8-3-4(5,6)7;1-3-4-2/h2H,1,3-6H2;2,5H,1,3-4H2;2H,1,3-5H2;2H,1,3H2;3H,1H2,2H3.
What are the key properties of 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene?
2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene has a molecular weight of 1076.61 g/mol, XLogP of 12.79, 25 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethenoxyethoxy)-1,1,1,3,3,3-hexafluoropropane;2-(2-ethenoxyethoxy)-1,1,1-trifluoroethane;8-(3-ethenoxypropoxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;2-ethenoxy-1,1,1-trifluoroethane;methoxyethene is sourced from PubChem (CID 91395037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).