1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene

C6H6F4O3 — CID 175138876

IUPAC1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene
SMILESCOC(OC(OC)=C(F)F)=C(F)F
InChIInChI=1S/C6H6F4O3/c1-11-5(3(7)8)13-6(12-2)4(9)10/h1-2H3
InChIKeyYACLOCSYVRONMA-UHFFFAOYSA-N
MW202.10 g/mol
LogP2.43
Rot. Bonds4

About 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene

1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene (PubChem CID 175138876) has the molecular formula C6H6F4O3 and a molecular weight of 202.10 g/mol. Its IUPAC name is 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene.

Molecular Properties

Compound Name1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene
PubChem CID175138876
Molecular FormulaC6H6F4O3
Molecular Weight202.10 g/mol
Exact Mass202.03
IUPAC Name1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene
SMILESCOC(OC(OC)=C(F)F)=C(F)F
InChIInChI=1S/C6H6F4O3/c1-11-5(3(7)8)13-6(12-2)4(9)10/h1-2H3
InChIKeyYACLOCSYVRONMA-UHFFFAOYSA-N
XLogP2.43
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.10
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene?
The IUPAC name of 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene (CID 175138876) is 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene.
What is the SMILES notation for 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene?
The canonical SMILES for 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene is COC(OC(OC)=C(F)F)=C(F)F.
What is the InChIKey of 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene?
The InChIKey is YACLOCSYVRONMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F4O3/c1-11-5(3(7)8)13-6(12-2)4(9)10/h1-2H3.
What are the key properties of 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene?
1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene has a molecular weight of 202.10 g/mol, XLogP of 2.43, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoro-1-methoxyethenoxy)-2,2-difluoro-1-methoxyethene is sourced from PubChem (CID 175138876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).