(2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite

C3F4O3 — CID 21040471

IUPAC(2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite
SMILESFOC1=C(F)OC(F)(F)O1
InChIInChI=1S/C3F4O3/c4-1-2(10-7)9-3(5,6)8-1
InChIKeyQYFLDSUDMJIXNS-UHFFFAOYSA-N
MW160.02 g/mol
LogP1.58
Rot. Bonds1

About (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite

(2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite (PubChem CID 21040471) has the molecular formula C3F4O3 and a molecular weight of 160.02 g/mol. Its IUPAC name is (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite.

Molecular Properties

Compound Name(2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite
PubChem CID21040471
Molecular FormulaC3F4O3
Molecular Weight160.02 g/mol
Exact Mass159.98
IUPAC Name(2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite
SMILESFOC1=C(F)OC(F)(F)O1
InChIInChI=1S/C3F4O3/c4-1-2(10-7)9-3(5,6)8-1
InChIKeyQYFLDSUDMJIXNS-UHFFFAOYSA-N
XLogP1.58
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.02
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-Dioxole, 2,2,4-trifluoro-5-(trifluoromethoxy)-
CID 9837206
1-[Difluoro(trifluoromethoxy)methoxy]-1,2,2-trifluoroethene
CID 71405026
1,1'-((Difluoromethylene)bis(oxy))bis(1,2,2-trifluoroethylene)
CID 83770
1-[Difluoro(pentafluoroethoxy)methoxy]-1,2,2-trifluoroethene
CID 15515048
CID 87077445
CID 87077445
1,3-Dioxole, 4,5-difluoro-2,2-bis(trifluoromethyl)-
CID 169957
Perfluorodioxole
CID 11744752
Perfluoro-2-Ethyl-2-Methyl-1,3-Dioxole
CID 14716215
2,2,4,5-Tetrafluoro-1,3-dioxole;1,1,2,2-tetrafluoroethene
CID 130234351
1,1,2,2-Tetrafluoroethene;2,2,4-trifluoro-5-(trifluoromethoxy)-1,3-dioxole
CID 158663025
1-[[[Difluoro(trifluoromethoxy)methoxy]-difluoromethoxy]-difluoromethoxy]-1,2,2-trifluoroethene
CID 11046707
Perfluoro-2-ethyl-1,3-dioxole
CID 14716214

Frequently Asked Questions

What is the IUPAC name of (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite?
The IUPAC name of (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite (CID 21040471) is (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite.
What is the SMILES notation for (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite?
The canonical SMILES for (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite is FOC1=C(F)OC(F)(F)O1.
What is the InChIKey of (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite?
The InChIKey is QYFLDSUDMJIXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F4O3/c4-1-2(10-7)9-3(5,6)8-1.
What are the key properties of (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite?
(2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite has a molecular weight of 160.02 g/mol, XLogP of 1.58, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2,5-trifluoro-1,3-dioxol-4-yl) hypofluorite is sourced from PubChem (CID 21040471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).