2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane

C7H14F6O2 — CID 91023301

IUPAC2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane
SMILESCCCC(F)(F)F.COF.FCCOF
InChIInChI=1S/C4H7F3.C2H4F2O.CH3FO/c1-2-3-4(5,6)7;3-1-2-5-4;1-3-2/h2-3H2,1H3;1-2H2;1H3
InChIKeyUEZHOKVKTPYFRO-UHFFFAOYSA-N
MW244.17 g/mol
LogP3.72
Rot. Bonds3

About 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane

2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane (PubChem CID 91023301) has the molecular formula C7H14F6O2 and a molecular weight of 244.17 g/mol. Its IUPAC name is 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane.

Molecular Properties

Compound Name2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane
PubChem CID91023301
Molecular FormulaC7H14F6O2
Molecular Weight244.17 g/mol
Exact Mass244.09
IUPAC Name2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane
SMILESCCCC(F)(F)F.COF.FCCOF
InChIInChI=1S/C4H7F3.C2H4F2O.CH3FO/c1-2-3-4(5,6)7;3-1-2-5-4;1-3-2/h2-3H2,1H3;1-2H2;1H3
InChIKeyUEZHOKVKTPYFRO-UHFFFAOYSA-N
XLogP3.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.17
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane?
The IUPAC name of 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane (CID 91023301) is 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane.
What is the SMILES notation for 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane?
The canonical SMILES for 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane is CCCC(F)(F)F.COF.FCCOF.
What is the InChIKey of 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane?
The InChIKey is UEZHOKVKTPYFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7F3.C2H4F2O.CH3FO/c1-2-3-4(5,6)7;3-1-2-5-4;1-3-2/h2-3H2,1H3;1-2H2;1H3.
What are the key properties of 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane?
2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane has a molecular weight of 244.17 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethyl hypofluorite;methyl hypofluorite;1,1,1-trifluorobutane is sourced from PubChem (CID 91023301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).