(E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene

C5H4F4O2 — CID 19708223

IUPAC(E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene
SMILESF/C=C/OC(F)(F)O/C=C/F
InChIInChI=1S/C5H4F4O2/c6-1-3-10-5(8,9)11-4-2-7/h1-4H/b3-1+,4-2+
InChIKeyHAOUUEWXBDRGCM-ZPUQHVIOSA-N
MW172.08 g/mol
LogP2.45
Rot. Bonds4

About (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene

(E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene (PubChem CID 19708223) has the molecular formula C5H4F4O2 and a molecular weight of 172.08 g/mol. Its IUPAC name is (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene.

Molecular Properties

Compound Name(E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene
PubChem CID19708223
Molecular FormulaC5H4F4O2
Molecular Weight172.08 g/mol
Exact Mass172.01
IUPAC Name(E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene
SMILESF/C=C/OC(F)(F)O/C=C/F
InChIInChI=1S/C5H4F4O2/c6-1-3-10-5(8,9)11-4-2-7/h1-4H/b3-1+,4-2+
InChIKeyHAOUUEWXBDRGCM-ZPUQHVIOSA-N
XLogP2.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.08
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene?
The IUPAC name of (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene (CID 19708223) is (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene.
What is the SMILES notation for (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene?
The canonical SMILES for (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene is F/C=C/OC(F)(F)O/C=C/F.
What is the InChIKey of (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene?
The InChIKey is HAOUUEWXBDRGCM-ZPUQHVIOSA-N. The full InChI is InChI=1S/C5H4F4O2/c6-1-3-10-5(8,9)11-4-2-7/h1-4H/b3-1+,4-2+.
What are the key properties of (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene?
(E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene has a molecular weight of 172.08 g/mol, XLogP of 2.45, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-[difluoro-[(E)-2-fluoroethenoxy]methoxy]-2-fluoroethene is sourced from PubChem (CID 19708223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).