[[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite

C3HF7O3 — CID 174300370

IUPAC[[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite
SMILESFOC(F)(F)OC(F)(F)OC(F)F
InChIInChI=1S/C3HF7O3/c4-1(5)11-2(6,7)12-3(8,9)13-10/h1H
InChIKeyUXOPVQYRFIUFJP-UHFFFAOYSA-N
MW218.02 g/mol
LogP2.24
Rot. Bonds5

About [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite

[[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite (PubChem CID 174300370) has the molecular formula C3HF7O3 and a molecular weight of 218.02 g/mol. Its IUPAC name is [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite.

Molecular Properties

Compound Name[[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite
PubChem CID174300370
Molecular FormulaC3HF7O3
Molecular Weight218.02 g/mol
Exact Mass217.98
IUPAC Name[[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite
SMILESFOC(F)(F)OC(F)(F)OC(F)F
InChIInChI=1S/C3HF7O3/c4-1(5)11-2(6,7)12-3(8,9)13-10/h1H
InChIKeyUXOPVQYRFIUFJP-UHFFFAOYSA-N
XLogP2.24
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.02
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Bis(difluoromethoxy)difluoromethane
CID 10130251
Oxybis[(difluoromethoxy)difluoromethane]
CID 10220579
Difluorobis(trifluoromethoxy)methane
CID 22016181
Pentafluorodimethoxymethane
CID 136664204
Trifluoro(fluoromethoxymethoxy)methane
CID 20650242
Difluoro-(fluoromethoxy)-(trifluoromethoxy)methane
CID 20746276
Fluoromethyl trifluoromethyl carbonate
CID 20871002
Trifluoromethoxymethyl hypofluorite
CID 23576718
[Difluoro(fluoromethoxy)methoxy]methyl hypofluorite
CID 53981058
Trifluoro(trifluoromethoxymethoxy)methane
CID 54208349
Difluoro-methoxy-(trifluoromethoxy)methane
CID 57577895
[Fluoro(trifluoromethoxy)methyl] hypofluorite
CID 57828726

Frequently Asked Questions

What is the IUPAC name of [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite?
The IUPAC name of [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite (CID 174300370) is [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite.
What is the SMILES notation for [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite?
The canonical SMILES for [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite is FOC(F)(F)OC(F)(F)OC(F)F.
What is the InChIKey of [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite?
The InChIKey is UXOPVQYRFIUFJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3HF7O3/c4-1(5)11-2(6,7)12-3(8,9)13-10/h1H.
What are the key properties of [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite?
[[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite has a molecular weight of 218.02 g/mol, XLogP of 2.24, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[difluoromethoxy(difluoro)methoxy]-difluoromethyl] hypofluorite is sourced from PubChem (CID 174300370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).