(E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene

C8H10F6O — CID 135128649

IUPAC(E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene
SMILESCCOC(F)(F)/C(F)=C(\F)C(F)(F)CC
InChIInChI=1S/C8H10F6O/c1-3-7(11,12)5(9)6(10)8(13,14)15-4-2/h3-4H2,1-2H3/b6-5+
InChIKeyRNBUNIGAYSPVHU-AATRIKPKSA-N
MW236.15 g/mol
LogP3.81
Rot. Bonds5

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

(E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene (PubChem CID 135128649) has the molecular formula C8H10F6O and a molecular weight of 236.15 g/mol. Its IUPAC name is (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene.

Molecular Properties

Compound Name(E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene
PubChem CID135128649
Molecular FormulaC8H10F6O
Molecular Weight236.15 g/mol
Exact Mass236.06
IUPAC Name(E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene
SMILESCCOC(F)(F)/C(F)=C(\F)C(F)(F)CC
InChIInChI=1S/C8H10F6O/c1-3-7(11,12)5(9)6(10)8(13,14)15-4-2/h3-4H2,1-2H3/b6-5+
InChIKeyRNBUNIGAYSPVHU-AATRIKPKSA-N
XLogP3.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.15
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4,4,5,5,6,6,6-Octafluoro-1-methoxyhex-2-ene
CID 71429342
4-Ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene
CID 12756904
(Z)-1,1,2,3-tetrafluoro-1-[(Z)-1,1,2,3-tetrafluoropent-2-enoxy]pent-2-ene
CID 87256324
(Z)-1,1,2,3-tetrafluoro-1-[(Z)-1,1,2,3-tetrafluorohex-2-enoxy]hex-2-ene
CID 88266507
(Z)-1,1,2-trifluoro-1-[(Z)-1,1,2-trifluoropent-2-enoxy]pent-2-ene
CID 88481339
(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
4,4,5,5,6,6,6-Heptafluoro-3-methyl-1-propoxyhex-2-ene
CID 90704672
4,4,5,5,6,6,6-Heptafluoro-1-propoxyhex-2-ene
CID 90755162
1-Ethoxy-4,4,5,5,6,6,6-heptafluorohex-2-ene
CID 91414688
1-Ethoxy-4,4,5,5,6,6,6-heptafluoro-3-methylhex-2-ene
CID 91803276
(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

Frequently Asked Questions

What is the IUPAC name of (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene?
The IUPAC name of (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene (CID 135128649) is (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene.
What is the SMILES notation for (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene?
The canonical SMILES for (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene is CCOC(F)(F)/C(F)=C(\F)C(F)(F)CC.
What is the InChIKey of (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene?
The InChIKey is RNBUNIGAYSPVHU-AATRIKPKSA-N. The full InChI is InChI=1S/C8H10F6O/c1-3-7(11,12)5(9)6(10)8(13,14)15-4-2/h3-4H2,1-2H3/b6-5+.
What are the key properties of (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene?
(E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene has a molecular weight of 236.15 g/mol, XLogP of 3.81, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-ethoxy-1,1,2,3,4,4-hexafluorohex-2-ene is sourced from PubChem (CID 135128649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).