3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene

C10H6F8O2 — CID 10018238

IUPAC3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene
SMILESCOC1=C(C2=C(OC)C(F)(F)C2(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C10H6F8O2/c1-19-5-3(7(11,12)9(5,15)16)4-6(20-2)10(17,18)8(4,13)14/h1-2H3
InChIKeyFXCVKBNEHFJZGM-UHFFFAOYSA-N
MW310.14 g/mol
LogP3.36
Rot. Bonds3

About 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene

3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene (PubChem CID 10018238) has the molecular formula C10H6F8O2 and a molecular weight of 310.14 g/mol. Its IUPAC name is 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene.

Molecular Properties

Compound Name3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene
PubChem CID10018238
Molecular FormulaC10H6F8O2
Molecular Weight310.14 g/mol
Exact Mass310.02
IUPAC Name3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene
SMILESCOC1=C(C2=C(OC)C(F)(F)C2(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C10H6F8O2/c1-19-5-3(7(11,12)9(5,15)16)4-6(20-2)10(17,18)8(4,13)14/h1-2H3
InChIKeyFXCVKBNEHFJZGM-UHFFFAOYSA-N
XLogP3.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.14
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3,3,4,4,5,5-Heptafluoro-2-(3,3,4,4,5,5-hexafluoro-2-methoxycyclopenten-1-yl)cyclopentene
CID 10000896
2,2'-Dimethoxy-3,3,3',3',4,4,4',4',5,5,5',5'-dodecafluoro-1,1'-bi(1-cyclopentene)
CID 10386828
2-Ethoxy-1-(2-ethoxy-3,3-difluorocyclobuten-1-yl)-3,3-difluorocyclobutene
CID 121001002

Frequently Asked Questions

What is the IUPAC name of 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene?
The IUPAC name of 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene (CID 10018238) is 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene.
What is the SMILES notation for 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene?
The canonical SMILES for 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene is COC1=C(C2=C(OC)C(F)(F)C2(F)F)C(F)(F)C1(F)F.
What is the InChIKey of 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene?
The InChIKey is FXCVKBNEHFJZGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F8O2/c1-19-5-3(7(11,12)9(5,15)16)4-6(20-2)10(17,18)8(4,13)14/h1-2H3.
What are the key properties of 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene?
3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene has a molecular weight of 310.14 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4-tetrafluoro-1-methoxy-2-(3,3,4,4-tetrafluoro-2-methoxycyclobuten-1-yl)cyclobutene is sourced from PubChem (CID 10018238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).