fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane

C9H8F10O — CID 91144902

IUPACfluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane
SMILESC=C(F)C(F)(F)OC(CC(F)(F)F)C(F)(F)F.C=CF
InChIInChI=1S/C7H5F9O.C2H3F/c1-3(8)7(15,16)17-4(6(12,13)14)2-5(9,10)11;1-2-3/h4H,1-2H2;2H,1H2
InChIKeySNHVOMYWMQUOLZ-UHFFFAOYSA-N
MW322.14 g/mol
LogP5.06
Rot. Bonds4

About fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane

fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane (PubChem CID 91144902) has the molecular formula C9H8F10O and a molecular weight of 322.14 g/mol. Its IUPAC name is fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane.

Molecular Properties

Compound Namefluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane
PubChem CID91144902
Molecular FormulaC9H8F10O
Molecular Weight322.14 g/mol
Exact Mass322.04
IUPAC Namefluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane
SMILESC=C(F)C(F)(F)OC(CC(F)(F)F)C(F)(F)F.C=CF
InChIInChI=1S/C7H5F9O.C2H3F/c1-3(8)7(15,16)17-4(6(12,13)14)2-5(9,10)11;1-2-3/h4H,1-2H2;2H,1H2
InChIKeySNHVOMYWMQUOLZ-UHFFFAOYSA-N
XLogP5.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.14
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane with MolForge

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Related Compounds

Ethene;1,1,2,2-tetrafluoroethene;3-(1,1,2,2-tetrafluoroethoxy)prop-1-ene
CID 44146746
3-[(1,1,1,3,3,3-Hexafluoropropan-2-yl)oxy]prop-1-ene
CID 21431670
4,5,5-Trifluoro-3-(4,5,5-trifluoropent-1-en-3-yloxy)pent-1-ene
CID 21758843
1,1,2-Trifluoro-3-(1,1,2-trifluoropenta-1,4-dien-3-yloxy)penta-1,4-diene
CID 22993249
1,1,1,3,3-Pentafluoro-2-prop-2-enoxypropane
CID 54048830
1,1,3,3-Tetrafluoro-2-prop-2-enoxypropane
CID 54495820
1,1,1,3-Tetrafluoro-2-prop-2-enoxypropane
CID 57077091
1,1,3-Trifluoro-2-prop-2-enoxypropane
CID 57128345
5,5,5-Trifluoro-3-(5,5,5-trifluoropent-1-en-3-yloxy)pent-1-ene
CID 57173601
1,1,1,4,4,4-Hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane
CID 58860327
1,1,1,2,3,3-Hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)-3-(1,1,1-trifluoro-3-prop-2-enoxypropan-2-yl)oxypropane
CID 59628136
4,5,5,5-Tetrafluoro-3-(4,5,5,5-tetrafluoropent-1-en-3-yloxy)pent-1-ene
CID 87256327

Frequently Asked Questions

What is the IUPAC name of fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane?
The IUPAC name of fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane (CID 91144902) is fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane.
What is the SMILES notation for fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane?
The canonical SMILES for fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane is C=C(F)C(F)(F)OC(CC(F)(F)F)C(F)(F)F.C=CF.
What is the InChIKey of fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane?
The InChIKey is SNHVOMYWMQUOLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F9O.C2H3F/c1-3(8)7(15,16)17-4(6(12,13)14)2-5(9,10)11;1-2-3/h4H,1-2H2;2H,1H2.
What are the key properties of fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane?
fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane has a molecular weight of 322.14 g/mol, XLogP of 5.06, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroethene;1,1,1,4,4,4-hexafluoro-2-(1,1,2-trifluoroprop-2-enoxy)butane is sourced from PubChem (CID 91144902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).