CID 175927772

H4F2LiNO6S2 — CID 175927772

IUPAC—
SMILESN.O=S(=O)(O)F.O=S(=O)([O-])F.[Li+]
InChIInChI=1S/2FHO3S.Li.H3N/c2*1-5(2,3)4;;/h2*(H,2,3,4);;1H3/q;;+1;/p-1
InChIKeyWCMWSLCKGNQXBN-UHFFFAOYSA-M
MW223.10 g/mol
LogP-3.66
Rot. Bonds

About CID 175927772

CID 175927772 (PubChem CID 175927772) has the molecular formula H4F2LiNO6S2 and a molecular weight of 223.10 g/mol.

Molecular Properties

Compound NameCID 175927772
PubChem CID175927772
Molecular FormulaH4F2LiNO6S2
Molecular Weight223.10 g/mol
Exact Mass222.96
IUPAC Name—
SMILESN.O=S(=O)(O)F.O=S(=O)([O-])F.[Li+]
InChIInChI=1S/2FHO3S.Li.H3N/c2*1-5(2,3)4;;/h2*(H,2,3,4);;1H3/q;;+1;/p-1
InChIKeyWCMWSLCKGNQXBN-UHFFFAOYSA-M
XLogP-3.66
TPSA146.57 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.10
LogP ≤ 5-3.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 175927772?
The IUPAC name of CID 175927772 (CID 175927772) is not available.
What is the SMILES notation for CID 175927772?
The canonical SMILES for CID 175927772 is N.O=S(=O)(O)F.O=S(=O)([O-])F.[Li+].
What is the InChIKey of CID 175927772?
The InChIKey is WCMWSLCKGNQXBN-UHFFFAOYSA-M. The full InChI is InChI=1S/2FHO3S.Li.H3N/c2*1-5(2,3)4;;/h2*(H,2,3,4);;1H3/q;;+1;/p-1.
What are the key properties of CID 175927772?
CID 175927772 has a molecular weight of 223.10 g/mol, XLogP of -3.66, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175927772 is sourced from PubChem (CID 175927772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).