potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid

C3H7F3KNO3S — CID 173392627

IUPACpotassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid
SMILESCC(NS(=O)(=O)O)C(F)(F)F.[H-].[K+]
InChIInChI=1S/C3H6F3NO3S.K.H/c1-2(3(4,5)6)7-11(8,9)10;;/h2,7H,1H3,(H,8,9,10);;/q;+1;-1
InChIKeyQDQTXYSCUBQPMF-UHFFFAOYSA-N
MW233.25 g/mol
LogP-2.55
Rot. Bonds2

About potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid

potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid (PubChem CID 173392627) has the molecular formula C3H7F3KNO3S and a molecular weight of 233.25 g/mol. Its IUPAC name is potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid.

Molecular Properties

Compound Namepotassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid
PubChem CID173392627
Molecular FormulaC3H7F3KNO3S
Molecular Weight233.25 g/mol
Exact Mass232.97
IUPAC Namepotassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid
SMILESCC(NS(=O)(=O)O)C(F)(F)F.[H-].[K+]
InChIInChI=1S/C3H6F3NO3S.K.H/c1-2(3(4,5)6)7-11(8,9)10;;/h2,7H,1H3,(H,8,9,10);;/q;+1;-1
InChIKeyQDQTXYSCUBQPMF-UHFFFAOYSA-N
XLogP-2.55
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.25
LogP ≤ 5-2.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid?
The IUPAC name of potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid (CID 173392627) is potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid.
What is the SMILES notation for potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid?
The canonical SMILES for potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid is CC(NS(=O)(=O)O)C(F)(F)F.[H-].[K+].
What is the InChIKey of potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid?
The InChIKey is QDQTXYSCUBQPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6F3NO3S.K.H/c1-2(3(4,5)6)7-11(8,9)10;;/h2,7H,1H3,(H,8,9,10);;/q;+1;-1.
What are the key properties of potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid?
potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid has a molecular weight of 233.25 g/mol, XLogP of -2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;hydride;1,1,1-trifluoropropan-2-ylsulfamic acid is sourced from PubChem (CID 173392627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).