(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene

C7H8F6O2 — CID 162581011

IUPAC(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene
SMILESCO/C(=C\C(OC)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H8F6O2/c1-14-4(6(8,9)10)3-5(15-2)7(11,12)13/h3-4H,1-2H3/b5-3-
InChIKeyVPWBOMFSHPDGLG-HYXAFXHYSA-N
MW238.13 g/mol
LogP2.66
Rot. Bonds3

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

(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene (PubChem CID 162581011) has the molecular formula C7H8F6O2 and a molecular weight of 238.13 g/mol. Its IUPAC name is (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene.

Molecular Properties

Compound Name(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene
PubChem CID162581011
Molecular FormulaC7H8F6O2
Molecular Weight238.13 g/mol
Exact Mass238.04
IUPAC Name(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene
SMILESCO/C(=C\C(OC)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H8F6O2/c1-14-4(6(8,9)10)3-5(15-2)7(11,12)13/h3-4H,1-2H3/b5-3-
InChIKeyVPWBOMFSHPDGLG-HYXAFXHYSA-N
XLogP2.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.13
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene?
The IUPAC name of (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene (CID 162581011) is (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene.
What is the SMILES notation for (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene?
The canonical SMILES for (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene is CO/C(=C\C(OC)C(F)(F)F)C(F)(F)F.
What is the InChIKey of (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene?
The InChIKey is VPWBOMFSHPDGLG-HYXAFXHYSA-N. The full InChI is InChI=1S/C7H8F6O2/c1-14-4(6(8,9)10)3-5(15-2)7(11,12)13/h3-4H,1-2H3/b5-3-.
What are the key properties of (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene?
(Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene has a molecular weight of 238.13 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,1,5,5,5-hexafluoro-2,4-dimethoxypent-2-ene is sourced from PubChem (CID 162581011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).