1,3-difluoropropan-2-yl hypofluorite

C3H5F3O — CID 20633868

IUPAC1,3-difluoropropan-2-yl hypofluorite
SMILESFCC(CF)OF
InChIInChI=1S/C3H5F3O/c4-1-3(2-5)7-6/h3H,1-2H2
InChIKeyLSVAWNDTWCZRFO-UHFFFAOYSA-N
MW114.07 g/mol
LogP1.20
Rot. Bonds3

About 1,3-difluoropropan-2-yl hypofluorite

1,3-difluoropropan-2-yl hypofluorite (PubChem CID 20633868) has the molecular formula C3H5F3O and a molecular weight of 114.07 g/mol. Its IUPAC name is 1,3-difluoropropan-2-yl hypofluorite.

Molecular Properties

Compound Name1,3-difluoropropan-2-yl hypofluorite
PubChem CID20633868
Molecular FormulaC3H5F3O
Molecular Weight114.07 g/mol
Exact Mass114.03
IUPAC Name1,3-difluoropropan-2-yl hypofluorite
SMILESFCC(CF)OF
InChIInChI=1S/C3H5F3O/c4-1-3(2-5)7-6/h3H,1-2H2
InChIKeyLSVAWNDTWCZRFO-UHFFFAOYSA-N
XLogP1.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.07
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,3-difluoropropan-2-yl hypofluorite?
The IUPAC name of 1,3-difluoropropan-2-yl hypofluorite (CID 20633868) is 1,3-difluoropropan-2-yl hypofluorite.
What is the SMILES notation for 1,3-difluoropropan-2-yl hypofluorite?
The canonical SMILES for 1,3-difluoropropan-2-yl hypofluorite is FCC(CF)OF.
What is the InChIKey of 1,3-difluoropropan-2-yl hypofluorite?
The InChIKey is LSVAWNDTWCZRFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5F3O/c4-1-3(2-5)7-6/h3H,1-2H2.
What are the key properties of 1,3-difluoropropan-2-yl hypofluorite?
1,3-difluoropropan-2-yl hypofluorite has a molecular weight of 114.07 g/mol, XLogP of 1.20, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-difluoropropan-2-yl hypofluorite is sourced from PubChem (CID 20633868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).