trisodium;hydrogen sulfite;bromide;chloride

HBrClNa3O3S — CID 172849286

IUPACtrisodium;hydrogen sulfite;bromide;chloride
SMILESO=S([O-])O.[Br-].[Cl-].[Na+].[Na+].[Na+]
InChIInChI=1S/BrH.ClH.3Na.H2O3S/c;;;;;1-4(2)3/h2*1H;;;;(H2,1,2,3)/q;;3*+1;/p-3
InChIKeyXVSBPIZIOSSSRZ-UHFFFAOYSA-K
MW265.40 g/mol
LogP-15.64
Rot. Bonds

About trisodium;hydrogen sulfite;bromide;chloride

trisodium;hydrogen sulfite;bromide;chloride (PubChem CID 172849286) has the molecular formula HBrClNa3O3S and a molecular weight of 265.40 g/mol. Its IUPAC name is trisodium;hydrogen sulfite;bromide;chloride.

Molecular Properties

Compound Nametrisodium;hydrogen sulfite;bromide;chloride
PubChem CID172849286
Molecular FormulaHBrClNa3O3S
Molecular Weight265.40 g/mol
Exact Mass263.82
IUPAC Nametrisodium;hydrogen sulfite;bromide;chloride
SMILESO=S([O-])O.[Br-].[Cl-].[Na+].[Na+].[Na+]
InChIInChI=1S/BrH.ClH.3Na.H2O3S/c;;;;;1-4(2)3/h2*1H;;;;(H2,1,2,3)/q;;3*+1;/p-3
InChIKeyXVSBPIZIOSSSRZ-UHFFFAOYSA-K
XLogP-15.64
TPSA60.36 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 5-15.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trisodium;hydrogen sulfite;bromide;chloride?
The IUPAC name of trisodium;hydrogen sulfite;bromide;chloride (CID 172849286) is trisodium;hydrogen sulfite;bromide;chloride.
What is the SMILES notation for trisodium;hydrogen sulfite;bromide;chloride?
The canonical SMILES for trisodium;hydrogen sulfite;bromide;chloride is O=S([O-])O.[Br-].[Cl-].[Na+].[Na+].[Na+].
What is the InChIKey of trisodium;hydrogen sulfite;bromide;chloride?
The InChIKey is XVSBPIZIOSSSRZ-UHFFFAOYSA-K. The full InChI is InChI=1S/BrH.ClH.3Na.H2O3S/c;;;;;1-4(2)3/h2*1H;;;;(H2,1,2,3)/q;;3*+1;/p-3.
What are the key properties of trisodium;hydrogen sulfite;bromide;chloride?
trisodium;hydrogen sulfite;bromide;chloride has a molecular weight of 265.40 g/mol, XLogP of -15.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trisodium;hydrogen sulfite;bromide;chloride is sourced from PubChem (CID 172849286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).