tert-butyl hypofluorite

C4H9FO — CID 20975703

IUPACtert-butyl hypofluorite
SMILESCC(C)(C)OF
InChIInChI=1S/C4H9FO/c1-4(2,3)6-5/h1-3H3
InChIKeyQEXALZRNBZDFCB-UHFFFAOYSA-N
MW92.11 g/mol
LogP1.69
Rot. Bonds

About tert-butyl hypofluorite

tert-butyl hypofluorite (PubChem CID 20975703) has the molecular formula C4H9FO and a molecular weight of 92.11 g/mol. Its IUPAC name is tert-butyl hypofluorite.

Molecular Properties

Compound Nametert-butyl hypofluorite
PubChem CID20975703
Molecular FormulaC4H9FO
Molecular Weight92.11 g/mol
Exact Mass92.06
IUPAC Nametert-butyl hypofluorite
SMILESCC(C)(C)OF
InChIInChI=1S/C4H9FO/c1-4(2,3)6-5/h1-3H3
InChIKeyQEXALZRNBZDFCB-UHFFFAOYSA-N
XLogP1.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.11
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Potassium T-butoxide
CID 23665647
2-Propanol, 2-methyl-, lithium salt (1:1)
CID 23664764
Sodium t-butoxide
CID 23676156
Tert-Butyl hypochlorite
CID 521297
2-Methylpropan-2-olate
CID 4574913
tert-Butoxy
CID 3080593
Rubidium 2-methylpropan-2-olate
CID 23673103
Cesium 2-methylpropan-2-olate
CID 23682183
2-Methylbutan-2-olate
CID 5086053
Tert-butyl hypoiodite
CID 12253183
tert-Butyl hypobromite
CID 12654691
t-Butoxysulfurane
CID 22119457

Frequently Asked Questions

What is the IUPAC name of tert-butyl hypofluorite?
The IUPAC name of tert-butyl hypofluorite (CID 20975703) is tert-butyl hypofluorite.
What is the SMILES notation for tert-butyl hypofluorite?
The canonical SMILES for tert-butyl hypofluorite is CC(C)(C)OF.
What is the InChIKey of tert-butyl hypofluorite?
The InChIKey is QEXALZRNBZDFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FO/c1-4(2,3)6-5/h1-3H3.
What are the key properties of tert-butyl hypofluorite?
tert-butyl hypofluorite has a molecular weight of 92.11 g/mol, XLogP of 1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl hypofluorite is sourced from PubChem (CID 20975703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).