1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium

C7H5F6OY- — CID 147732617

IUPAC1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium
SMILESCCOC1=[C-]C(F)(F)C(F)(F)C1(F)F.[Y]
InChIInChI=1S/C7H5F6O.Y/c1-2-14-4-3-5(8,9)7(12,13)6(4,10)11;/h2H2,1H3;/q-1;
InChIKeyWWPIVQQTSKYBFT-UHFFFAOYSA-N
MW308.01 g/mol
LogP2.63
Rot. Bonds2

About 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium

1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium (PubChem CID 147732617) has the molecular formula C7H5F6OY- and a molecular weight of 308.01 g/mol. Its IUPAC name is 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium.

Molecular Properties

Compound Name1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium
PubChem CID147732617
Molecular FormulaC7H5F6OY-
Molecular Weight308.01 g/mol
Exact Mass307.93
IUPAC Name1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium
SMILESCCOC1=[C-]C(F)(F)C(F)(F)C1(F)F.[Y]
InChIInChI=1S/C7H5F6O.Y/c1-2-14-4-3-5(8,9)7(12,13)6(4,10)11;/h2H2,1H3;/q-1;
InChIKeyWWPIVQQTSKYBFT-UHFFFAOYSA-N
XLogP2.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.01
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,3,3,4,4,5,5-Heptafluoro-2-methoxycyclopentene
CID 74476
1-Ethoxy-2,3,3,4,4,5,5,6,6-nonafluorocyclohex-1-ene
CID 75258
1-Ethoxy-2,3,3,4,4,5,5-heptafluorocyclopent-1-ene
CID 17906083
(E)-1,1,1,2,2,3,5,5,6,6,7,7,8,8,8-pentadecafluoro-4-(2,2,3,3-tetrafluoropropoxy)oct-3-ene
CID 89614750
1,3,3,4,4,5,5-Heptafluoro-2-[2,2,3,3-tetrafluoro-4-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)oxybutoxy]cyclopentene
CID 134238175
1-Ethoxy-3,3,4,4,5,5-hexafluorocyclopentene
CID 140227295
3,3,4,4,5,5-Hexafluoro-1-(2,2,2-trifluoroethoxy)cyclopentene
CID 140227297
3,3,4,4,5,5-Hexafluoro-1-methoxycyclopentene
CID 140227298
1,3,3,4,4,5,5-Heptafluoro-2-(2,2,3,3-tetrafluoropropoxy)cyclopentene
CID 155670508
3,3,4,4,5,5-Hexafluoro-1-(2,2,3,3-tetrafluoropropoxy)cyclopentene
CID 155670522
3,3,4,4,5,5-Hexafluoro-1,2-bis(2,2,2-trifluoroethoxy)cyclopentene
CID 155670532
1,3,3,4,4,5,5-Heptafluoro-2-(2,2,2-trifluoroethoxy)cyclopentene
CID 155670543

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium?
The IUPAC name of 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium (CID 147732617) is 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium.
What is the SMILES notation for 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium?
The canonical SMILES for 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium is CCOC1=[C-]C(F)(F)C(F)(F)C1(F)F.[Y].
What is the InChIKey of 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium?
The InChIKey is WWPIVQQTSKYBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F6O.Y/c1-2-14-4-3-5(8,9)7(12,13)6(4,10)11;/h2H2,1H3;/q-1;.
What are the key properties of 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium?
1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium has a molecular weight of 308.01 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-3,3,4,4,5,5-hexafluorocyclopentene;yttrium is sourced from PubChem (CID 147732617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).