(E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene

C6H6F6O — CID 163363611

IUPAC(E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene
SMILESCOC/C(F)=C(\F)C(F)(F)C(F)F
InChIInChI=1S/C6H6F6O/c1-13-2-3(7)4(8)6(11,12)5(9)10/h5H,2H2,1H3/b4-3+
InChIKeyUBGNRDSCWCRROH-ONEGZZNKSA-N
MW208.10 g/mol
LogP2.68
Rot. Bonds4

About (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene

(E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene (PubChem CID 163363611) has the molecular formula C6H6F6O and a molecular weight of 208.10 g/mol. Its IUPAC name is (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene.

Molecular Properties

Compound Name(E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene
PubChem CID163363611
Molecular FormulaC6H6F6O
Molecular Weight208.10 g/mol
Exact Mass208.03
IUPAC Name(E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene
SMILESCOC/C(F)=C(\F)C(F)(F)C(F)F
InChIInChI=1S/C6H6F6O/c1-13-2-3(7)4(8)6(11,12)5(9)10/h5H,2H2,1H3/b4-3+
InChIKeyUBGNRDSCWCRROH-ONEGZZNKSA-N
XLogP2.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.10
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-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
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
4-Ethoxy-1,1,1,2,3,4,5,5,5-nonafluoropent-2-ene
CID 12756904
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
CID 87091254
CID 87091254
4,4,5,5,6,6,6-Heptafluoro-1-methoxyhex-2-ene
CID 91264552
(E)-1,1,2,3,4,4,5,5,5-nonafluoro-1-methoxypent-2-ene
CID 117820977
(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
(E)-1,1,2,3,4,4-hexafluoro-1-propoxypent-2-ene
CID 135128635

Frequently Asked Questions

What is the IUPAC name of (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene?
The IUPAC name of (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene (CID 163363611) is (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene.
What is the SMILES notation for (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene?
The canonical SMILES for (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene is COC/C(F)=C(\F)C(F)(F)C(F)F.
What is the InChIKey of (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene?
The InChIKey is UBGNRDSCWCRROH-ONEGZZNKSA-N. The full InChI is InChI=1S/C6H6F6O/c1-13-2-3(7)4(8)6(11,12)5(9)10/h5H,2H2,1H3/b4-3+.
What are the key properties of (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene?
(E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene has a molecular weight of 208.10 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2,3,4,4,5,5-hexafluoro-1-methoxypent-2-ene is sourced from PubChem (CID 163363611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).