(3,3,3-trifluoro-2-oxopropyl) hypofluorite

C3H2F4O2 — CID 22889463

IUPAC(3,3,3-trifluoro-2-oxopropyl) hypofluorite
SMILESO=C(COF)C(F)(F)F
InChIInChI=1S/C3H2F4O2/c4-3(5,6)2(8)1-9-7/h1H2
InChIKeyBWPDQFKRYASYDP-UHFFFAOYSA-N
MW146.04 g/mol
LogP1.02
Rot. Bonds2

About (3,3,3-trifluoro-2-oxopropyl) hypofluorite

(3,3,3-trifluoro-2-oxopropyl) hypofluorite (PubChem CID 22889463) has the molecular formula C3H2F4O2 and a molecular weight of 146.04 g/mol. Its IUPAC name is (3,3,3-trifluoro-2-oxopropyl) hypofluorite.

Molecular Properties

Compound Name(3,3,3-trifluoro-2-oxopropyl) hypofluorite
PubChem CID22889463
Molecular FormulaC3H2F4O2
Molecular Weight146.04 g/mol
Exact Mass146.00
IUPAC Name(3,3,3-trifluoro-2-oxopropyl) hypofluorite
SMILESO=C(COF)C(F)(F)F
InChIInChI=1S/C3H2F4O2/c4-3(5,6)2(8)1-9-7/h1H2
InChIKeyBWPDQFKRYASYDP-UHFFFAOYSA-N
XLogP1.02
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.04
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione
CID 15360935
(4,4,4-trifluoro-3-oxobutanoyl) 4,4,4-trifluoro-3-oxobutanoate
CID 87675460
CID 10250683
CID 10250683
calcium;1,1,1,5,5,5-hexafluoropentane-2,4-dione;hydride
CID 173351670
1,1,1,3-tetrafluoropropan-2-one;hydrate
CID 87581262
4-amino-1,1,1,5,5,5-hexafluoropentan-2-one
CID 163555520
1,1,1-trifluoro-4-methoxybutan-2-one
CID 62962965
5,5,5-trifluoro-4-oxopentanoic acid
CID 20543330
cerium;1,1,1,3,3,3-hexafluoropropan-2-one
CID 90019366
tris(1,1,1,3,3,3-hexafluoropropan-2-one);iron
CID 159237842
1,1,1-trifluoro-4,4-bis(sulfanyl)butan-2-one
CID 22388928
1,1,1-trifluoropentane-2,4-dione;zirconium
CID 87257091

Frequently Asked Questions

What is the IUPAC name of (3,3,3-trifluoro-2-oxopropyl) hypofluorite?
The IUPAC name of (3,3,3-trifluoro-2-oxopropyl) hypofluorite (CID 22889463) is (3,3,3-trifluoro-2-oxopropyl) hypofluorite.
What is the SMILES notation for (3,3,3-trifluoro-2-oxopropyl) hypofluorite?
The canonical SMILES for (3,3,3-trifluoro-2-oxopropyl) hypofluorite is O=C(COF)C(F)(F)F.
What is the InChIKey of (3,3,3-trifluoro-2-oxopropyl) hypofluorite?
The InChIKey is BWPDQFKRYASYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F4O2/c4-3(5,6)2(8)1-9-7/h1H2.
What are the key properties of (3,3,3-trifluoro-2-oxopropyl) hypofluorite?
(3,3,3-trifluoro-2-oxopropyl) hypofluorite has a molecular weight of 146.04 g/mol, XLogP of 1.02, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3,3-trifluoro-2-oxopropyl) hypofluorite is sourced from PubChem (CID 22889463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).