potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride

C6H2F13KO — CID 174272678

IUPACpotassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride
SMILESOC(C(F)(F)F)(C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F.[H-].[K+]
InChIInChI=1S/C6HF13O.K.H/c7-1(3(8,9)10,4(11,12)13)2(20,5(14,15)16)6(17,18)19;;/h20H;;/q;+1;-1
InChIKeyLIKYGAVJLXPCFT-UHFFFAOYSA-N
MW376.15 g/mol
LogP0.79
Rot. Bonds1

About potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride

potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride (PubChem CID 174272678) has the molecular formula C6H2F13KO and a molecular weight of 376.15 g/mol. Its IUPAC name is potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride.

Molecular Properties

Compound Namepotassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride
PubChem CID174272678
Molecular FormulaC6H2F13KO
Molecular Weight376.15 g/mol
Exact Mass375.95
IUPAC Namepotassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride
SMILESOC(C(F)(F)F)(C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F.[H-].[K+]
InChIInChI=1S/C6HF13O.K.H/c7-1(3(8,9)10,4(11,12)13)2(20,5(14,15)16)6(17,18)19;;/h20H;;/q;+1;-1
InChIKeyLIKYGAVJLXPCFT-UHFFFAOYSA-N
XLogP0.79
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.15
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride?
The IUPAC name of potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride (CID 174272678) is potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride.
What is the SMILES notation for potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride?
The canonical SMILES for potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride is OC(C(F)(F)F)(C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F.[H-].[K+].
What is the InChIKey of potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride?
The InChIKey is LIKYGAVJLXPCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6HF13O.K.H/c7-1(3(8,9)10,4(11,12)13)2(20,5(14,15)16)6(17,18)19;;/h20H;;/q;+1;-1.
What are the key properties of potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride?
potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride has a molecular weight of 376.15 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;1,1,1,3,4,4,4-heptafluoro-2,3-bis(trifluoromethyl)butan-2-ol;hydride is sourced from PubChem (CID 174272678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).