CID 159180001

HCsFO3S — CID 159180001

IUPAC—
SMILESO=S(=O)(O)F.[Cs]
InChIInChI=1S/Cs.FHO3S/c;1-5(2,3)4/h;(H,2,3,4)
InChIKeyKMTOKXHFHHUMSN-UHFFFAOYSA-N
MW232.97 g/mol
LogP-0.62
Rot. Bonds

About CID 159180001

CID 159180001 (PubChem CID 159180001) has the molecular formula HCsFO3S and a molecular weight of 232.97 g/mol.

Molecular Properties

Compound NameCID 159180001
PubChem CID159180001
Molecular FormulaHCsFO3S
Molecular Weight232.97 g/mol
Exact Mass232.87
IUPAC Name—
SMILESO=S(=O)(O)F.[Cs]
InChIInChI=1S/Cs.FHO3S/c;1-5(2,3)4/h;(H,2,3,4)
InChIKeyKMTOKXHFHHUMSN-UHFFFAOYSA-N
XLogP-0.62
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.97
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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methyl-bis(trifluoromethyl)silane;sulfurofluoridic acid
CID 175521826
sulfooxy hydrogen sulfate
CID 24413
bismuthane;sulfuric acid
CID 174861750
(barium(2+));sulfuric acid
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Frequently Asked Questions

What is the IUPAC name of CID 159180001?
The IUPAC name of CID 159180001 (CID 159180001) is not available.
What is the SMILES notation for CID 159180001?
The canonical SMILES for CID 159180001 is O=S(=O)(O)F.[Cs].
What is the InChIKey of CID 159180001?
The InChIKey is KMTOKXHFHHUMSN-UHFFFAOYSA-N. The full InChI is InChI=1S/Cs.FHO3S/c;1-5(2,3)4/h;(H,2,3,4).
What are the key properties of CID 159180001?
CID 159180001 has a molecular weight of 232.97 g/mol, XLogP of -0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159180001 is sourced from PubChem (CID 159180001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).