(Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene

C6H3F9 — CID 87113279

IUPAC(Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene
SMILESF/C=C(/CC(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H3F9/c7-2-3(5(10,11)12)1-4(8,9)6(13,14)15/h2H,1H2/b3-2-
InChIKeyFMJIGSFEWYOQCR-IHWYPQMZSA-N
MW246.07 g/mol
LogP3.99
Rot. Bonds2

About (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene

(Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene (PubChem CID 87113279) has the molecular formula C6H3F9 and a molecular weight of 246.07 g/mol. Its IUPAC name is (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene.

Molecular Properties

Compound Name(Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene
PubChem CID87113279
Molecular FormulaC6H3F9
Molecular Weight246.07 g/mol
Exact Mass246.01
IUPAC Name(Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene
SMILESF/C=C(/CC(F)(F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H3F9/c7-2-3(5(10,11)12)1-4(8,9)6(13,14)15/h2H,1H2/b3-2-
InChIKeyFMJIGSFEWYOQCR-IHWYPQMZSA-N
XLogP3.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.07
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-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

1H-Perfluorohex-1-ene
CID 21455498
(1Z)-1,2,3,3,4,4,5,5,6,6,6-Undecafluorohex-1-ene
CID 14922985
(1E)-1,2,3,3,4,4,5,5,6,6,6-Undecafluorohex-1-ene
CID 71669145
1,1,4,4,5,5,5-Heptafluoro-2-(trifluoromethyl)-1-pentene
CID 11311586
2-Methyl-3,3,4,4,5,5,5-heptafluoro-pent-1-ene
CID 19091131
(E)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene
CID 23266236
4,4,5,5,5-Pentafluoro-2-(trifluoromethyl)pent-1-ene
CID 71429448
5,5,5-Trifluoro-2-(trifluoromethyl)pent-1-ene
CID 139426621
3,3,4,4,4-Pentafluoro-2-(trifluoromethyl)-1-butene
CID 10899977
1,1,2,2,3,3,4,4-Octafluoro-5-methylidenecyclopentane
CID 19035195
1,1,3,3,4,4,5,5,5-Nonafluoro-2-methylpent-1-ene
CID 19424809
1,1,3,3,4,4-Hexafluoro-2-(trifluoromethyl)pent-1-ene
CID 19788882

Frequently Asked Questions

What is the IUPAC name of (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene?
The IUPAC name of (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene (CID 87113279) is (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene.
What is the SMILES notation for (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene?
The canonical SMILES for (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene is F/C=C(/CC(F)(F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene?
The InChIKey is FMJIGSFEWYOQCR-IHWYPQMZSA-N. The full InChI is InChI=1S/C6H3F9/c7-2-3(5(10,11)12)1-4(8,9)6(13,14)15/h2H,1H2/b3-2-.
What are the key properties of (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene?
(Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene has a molecular weight of 246.07 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,4,4,5,5,5-hexafluoro-2-(trifluoromethyl)pent-1-ene is sourced from PubChem (CID 87113279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).