potassium;1-fluorooctane;hydride;sulfuric acid

C8H20FKO4S — CID 173036344

IUPACpotassium;1-fluorooctane;hydride;sulfuric acid
SMILESCCCCCCCCF.O=S(=O)(O)O.[H-].[K+]
InChIInChI=1S/C8H17F.K.H2O4S.H/c1-2-3-4-5-6-7-8-9;;1-5(2,3)4;/h2-8H2,1H3;;(H2,1,2,3,4);/q;+1;;-1
InChIKeyBJIJQKKDNSFFNZ-UHFFFAOYSA-N
MW270.41 g/mol
LogP-0.22
Rot. Bonds6

About potassium;1-fluorooctane;hydride;sulfuric acid

potassium;1-fluorooctane;hydride;sulfuric acid (PubChem CID 173036344) has the molecular formula C8H20FKO4S and a molecular weight of 270.41 g/mol. Its IUPAC name is potassium;1-fluorooctane;hydride;sulfuric acid.

Molecular Properties

Compound Namepotassium;1-fluorooctane;hydride;sulfuric acid
PubChem CID173036344
Molecular FormulaC8H20FKO4S
Molecular Weight270.41 g/mol
Exact Mass270.07
IUPAC Namepotassium;1-fluorooctane;hydride;sulfuric acid
SMILESCCCCCCCCF.O=S(=O)(O)O.[H-].[K+]
InChIInChI=1S/C8H17F.K.H2O4S.H/c1-2-3-4-5-6-7-8-9;;1-5(2,3)4;/h2-8H2,1H3;;(H2,1,2,3,4);/q;+1;;-1
InChIKeyBJIJQKKDNSFFNZ-UHFFFAOYSA-N
XLogP-0.22
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.41
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium;1-fluorooctane;hydride;sulfuric acid?
The IUPAC name of potassium;1-fluorooctane;hydride;sulfuric acid (CID 173036344) is potassium;1-fluorooctane;hydride;sulfuric acid.
What is the SMILES notation for potassium;1-fluorooctane;hydride;sulfuric acid?
The canonical SMILES for potassium;1-fluorooctane;hydride;sulfuric acid is CCCCCCCCF.O=S(=O)(O)O.[H-].[K+].
What is the InChIKey of potassium;1-fluorooctane;hydride;sulfuric acid?
The InChIKey is BJIJQKKDNSFFNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17F.K.H2O4S.H/c1-2-3-4-5-6-7-8-9;;1-5(2,3)4;/h2-8H2,1H3;;(H2,1,2,3,4);/q;+1;;-1.
What are the key properties of potassium;1-fluorooctane;hydride;sulfuric acid?
potassium;1-fluorooctane;hydride;sulfuric acid has a molecular weight of 270.41 g/mol, XLogP of -0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;1-fluorooctane;hydride;sulfuric acid is sourced from PubChem (CID 173036344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).