tripotassium;borate;sulfite

BK3O6S-2 — CID 19858262

IUPACtripotassium;borate;sulfite
SMILESO=S([O-])[O-].[K+].[K+].[K+].[O-]B([O-])[O-]
InChIInChI=1S/BO3.3K.H2O3S/c2-1(3)4;;;;1-4(2)3/h;;;;(H2,1,2,3)/q-3;3*+1;/p-2
InChIKeyUQSGXGJERINUQA-UHFFFAOYSA-L
MW256.17 g/mol
LogP-13.94
Rot. Bonds

About tripotassium;borate;sulfite

tripotassium;borate;sulfite (PubChem CID 19858262) has the molecular formula BK3O6S-2 and a molecular weight of 256.17 g/mol. Its IUPAC name is tripotassium;borate;sulfite.

Molecular Properties

Compound Nametripotassium;borate;sulfite
PubChem CID19858262
Molecular FormulaBK3O6S-2
Molecular Weight256.17 g/mol
Exact Mass255.84
IUPAC Nametripotassium;borate;sulfite
SMILESO=S([O-])[O-].[K+].[K+].[K+].[O-]B([O-])[O-]
InChIInChI=1S/BO3.3K.H2O3S/c2-1(3)4;;;;1-4(2)3/h;;;;(H2,1,2,3)/q-3;3*+1;/p-2
InChIKeyUQSGXGJERINUQA-UHFFFAOYSA-L
XLogP-13.94
TPSA132.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.17
LogP ≤ 5-13.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

cobalt(2+) sulfite
CID 18760923
ruthenium(2+) sulfite
CID 22610794
dicopper disulfite
CID 170844287
disodium;sulfite
CID 516934
bis(lutetium(3+));trisulfite
CID 159878392
chromium(2+) sulfite
CID 22462027
calcium;magnesium;disulfite
CID 22465809
disodium;sulfite;hexahydrate
CID 158498638
sodium;sulfite;hydrate
CID 19366461
hydron;iron(2+);sulfite
CID 20545645
calcium;sulfite;dihydrate
CID 23448497
disodium;methane;sulfite
CID 86619477

Frequently Asked Questions

What is the IUPAC name of tripotassium;borate;sulfite?
The IUPAC name of tripotassium;borate;sulfite (CID 19858262) is tripotassium;borate;sulfite.
What is the SMILES notation for tripotassium;borate;sulfite?
The canonical SMILES for tripotassium;borate;sulfite is O=S([O-])[O-].[K+].[K+].[K+].[O-]B([O-])[O-].
What is the InChIKey of tripotassium;borate;sulfite?
The InChIKey is UQSGXGJERINUQA-UHFFFAOYSA-L. The full InChI is InChI=1S/BO3.3K.H2O3S/c2-1(3)4;;;;1-4(2)3/h;;;;(H2,1,2,3)/q-3;3*+1;/p-2.
What are the key properties of tripotassium;borate;sulfite?
tripotassium;borate;sulfite has a molecular weight of 256.17 g/mol, XLogP of -13.94, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tripotassium;borate;sulfite is sourced from PubChem (CID 19858262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).