Sodium bentoniteProduct ingredient for Bentonite

Name
Sodium bentonite
Drug Entry
Bentonite
Accession Number
DBSALT001580
Structure
Synonyms
Not Available
UNII
K1BPI94O04
CAS Number
85049-30-5
Weight
Average: 422.286
Monoisotopic: 421.7998618
Chemical Formula
Al2H2Na2O13Si4
InChI Key
ONCZQWJXONKSMM-UHFFFAOYSA-N
InChI
InChI=1S/2Al.2Na.H2O.12O.4Si/h;;;;1H2;;;;;;;;;;;;;;;;/q2*+3;2*+1;;12*-2;4*+4
IUPAC Name
tetrasilicon(4+) ion dialuminium(3+) ion disodium hydrate dodecaoxidandiide
SMILES
O.[O--].[O--].[O--].[O--].[O--].[O--].[O--].[O--].[O--].[O--].[O--].[O--].[Na+].[Na+].[Al+3].[Al+3].[Si+4].[Si+4].[Si+4].[Si+4]
ChemSpider
32700031
Wikipedia
Bentonite
Predicted Properties
PropertyValueSource
logP-0.65Chemaxon
pKa (Strongest Acidic)15.7Chemaxon
pKa (Strongest Basic)-1.8Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count1Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area25.3 Å2Chemaxon
Rotatable Bond Count0Chemaxon
Refractivity3.7 m3·mol-1Chemaxon
Polarizability1.51 Å3Chemaxon
Number of Rings0Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon