(E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene

C7H5F9O — CID 12756904

IUPAC(E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene
SMILESCCOC(F)(/C(F)=C(\F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H5F9O/c1-2-17-5(10,7(14,15)16)3(8)4(9)6(11,12)13/h2H2,1H3/b4-3+
InChIKeyPIHYUVDUHZHXMX-ONEGZZNKSA-N
MW276.10 g/mol
LogP3.96
Rot. Bonds3

About (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene

(E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene (PubChem CID 12756904) has the molecular formula C7H5F9O and a molecular weight of 276.10 g/mol. Its IUPAC name is (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene.

Molecular Properties

Compound Name(E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene
PubChem CID12756904
Molecular FormulaC7H5F9O
Molecular Weight276.10 g/mol
Exact Mass276.02
IUPAC Name(E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene
SMILESCCOC(F)(/C(F)=C(\F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H5F9O/c1-2-17-5(10,7(14,15)16)3(8)4(9)6(11,12)13/h2H2,1H3/b4-3+
InChIKeyPIHYUVDUHZHXMX-ONEGZZNKSA-N
XLogP3.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.10
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,4,4,5,5,6,6,6-Octafluoro-1-methoxyhex-2-ene
CID 71429342
1,1,1,2,3,4,5,5,5-Nonafluoro-4-methoxypent-2-ene
CID 12756903
(E)-1,1,2,3,5,5,5-heptafluoro-1-methoxy-4-(trifluoromethyl)pent-2-ene
CID 12696166
1,1,1,2,4,4,5,5,5-Nonafluoro-3-(methoxymethyl)pent-2-ene
CID 91722772
1,1,1,3,4,4,5,5,5-Nonafluoro-2-(methoxymethyl)pent-2-ene
CID 91733916
1,1,1,2,3,5,5,5-Octafluoro-4-(1,1,1,3,4,5,5,5-octafluoropent-3-en-2-yloxy)pent-2-ene
CID 57212045
CID 87091254
CID 87091254
(Z)-1,1,2,3-tetrafluoro-1-[(Z)-1,1,2,3-tetrafluoropent-2-enoxy]pent-2-ene
CID 87256324
(E)-1,1,1,2,3,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-2-(2,2,3,3-tetrafluoropropoxy)oct-3-ene
CID 89614881
(2E,4E)-1,2,3,4,5,6,7,7,8,8,8-undecafluoro-6-propoxyocta-2,4-diene
CID 122591214
(E)-1,1,2,3,4,4-hexafluoro-1-methoxypent-2-ene
CID 135128622
(E)-1,1,2,3,4,4-hexafluoro-1-propoxyhex-2-ene
CID 135128626

Frequently Asked Questions

What is the IUPAC name of (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene?
The IUPAC name of (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene (CID 12756904) is (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene.
What is the SMILES notation for (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene?
The canonical SMILES for (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene is CCOC(F)(/C(F)=C(\F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene?
The InChIKey is PIHYUVDUHZHXMX-ONEGZZNKSA-N. The full InChI is InChI=1S/C7H5F9O/c1-2-17-5(10,7(14,15)16)3(8)4(9)6(11,12)13/h2H2,1H3/b4-3+.
What are the key properties of (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene?
(E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene has a molecular weight of 276.10 g/mol, XLogP of 3.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene is sourced from PubChem (CID 12756904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).