1,2-difluoro-1,2-bis(trifluoromethoxy)ethene

C4F8O2 — CID 86055919

IUPAC1,2-difluoro-1,2-bis(trifluoromethoxy)ethene
SMILESFC(OC(F)(F)F)=C(F)OC(F)(F)F
InChIInChI=1S/C4F8O2/c5-1(13-3(7,8)9)2(6)14-4(10,11)12
InChIKeyFHGSMRKFGWKPJZ-UHFFFAOYSA-N
MW232.03 g/mol
LogP3.12
Rot. Bonds2

About 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene

1,2-difluoro-1,2-bis(trifluoromethoxy)ethene (PubChem CID 86055919) has the molecular formula C4F8O2 and a molecular weight of 232.03 g/mol. Its IUPAC name is 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene.

Molecular Properties

Compound Name1,2-difluoro-1,2-bis(trifluoromethoxy)ethene
PubChem CID86055919
Molecular FormulaC4F8O2
Molecular Weight232.03 g/mol
Exact Mass231.98
IUPAC Name1,2-difluoro-1,2-bis(trifluoromethoxy)ethene
SMILESFC(OC(F)(F)F)=C(F)OC(F)(F)F
InChIInChI=1S/C4F8O2/c5-1(13-3(7,8)9)2(6)14-4(10,11)12
InChIKeyFHGSMRKFGWKPJZ-UHFFFAOYSA-N
XLogP3.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.03
LogP ≤ 53.12
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 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene?
The IUPAC name of 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene (CID 86055919) is 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene.
What is the SMILES notation for 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene?
The canonical SMILES for 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene is FC(OC(F)(F)F)=C(F)OC(F)(F)F.
What is the InChIKey of 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene?
The InChIKey is FHGSMRKFGWKPJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4F8O2/c5-1(13-3(7,8)9)2(6)14-4(10,11)12.
What are the key properties of 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene?
1,2-difluoro-1,2-bis(trifluoromethoxy)ethene has a molecular weight of 232.03 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-difluoro-1,2-bis(trifluoromethoxy)ethene is sourced from PubChem (CID 86055919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).