dihydrate;trihydrofluoride

H7F3O2 — CID 172814094

IUPACdihydrate;trihydrofluoride
SMILESF.F.F.O.O
InChIInChI=1S/3FH.2H2O/h3*1H;2*1H2
InChIKeySOTIJBYJZUHLRF-UHFFFAOYSA-N
MW96.05 g/mol
LogP-1.19
Rot. Bonds

About dihydrate;trihydrofluoride

dihydrate;trihydrofluoride (PubChem CID 172814094) has the molecular formula H7F3O2 and a molecular weight of 96.05 g/mol. Its IUPAC name is dihydrate;trihydrofluoride.

Molecular Properties

Compound Namedihydrate;trihydrofluoride
PubChem CID172814094
Molecular FormulaH7F3O2
Molecular Weight96.05 g/mol
Exact Mass96.04
IUPAC Namedihydrate;trihydrofluoride
SMILESF.F.F.O.O
InChIInChI=1S/3FH.2H2O/h3*1H;2*1H2
InChIKeySOTIJBYJZUHLRF-UHFFFAOYSA-N
XLogP-1.19
TPSA63.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.05
LogP ≤ 5-1.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Iron(III) fluoride trihydrate
CID 44890702
Cupric fluoride dihydrate
CID 24884278
Aluminium fluoride trihydrate
CID 22002992
Trifluoroalumane;trihydrate
CID 16211015
Chromium(III) fluoride trihydrate
CID 21330797
Indium(III) fluoride trihydrate
CID 53442955
Gallium trifluoride trihydrate
CID 71587050
Copper(II) fluoride hydrate
CID 91886633
Copper difluoride trihydrate
CID 91886634
ZINC fluoride dihydrate
CID 129696455
Fluorine dihydrate
CID 129809360
Vanadium trifluoride trihydrate
CID 71586934

Frequently Asked Questions

What is the IUPAC name of dihydrate;trihydrofluoride?
The IUPAC name of dihydrate;trihydrofluoride (CID 172814094) is dihydrate;trihydrofluoride.
What is the SMILES notation for dihydrate;trihydrofluoride?
The canonical SMILES for dihydrate;trihydrofluoride is F.F.F.O.O.
What is the InChIKey of dihydrate;trihydrofluoride?
The InChIKey is SOTIJBYJZUHLRF-UHFFFAOYSA-N. The full InChI is InChI=1S/3FH.2H2O/h3*1H;2*1H2.
What are the key properties of dihydrate;trihydrofluoride?
dihydrate;trihydrofluoride has a molecular weight of 96.05 g/mol, XLogP of -1.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dihydrate;trihydrofluoride is sourced from PubChem (CID 172814094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).