aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate

H3AlKMoO8PS2Si — CID 173350451

IUPACaluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate
SMILESO=P(O)(O)O.S=[Mo]=S.[Al+3].[K+].[O-][Si]([O-])([O-])[O-]
InChIInChI=1S/Al.K.Mo.H3O4P.O4Si.2S/c;;;2*1-5(2,3)4;;/h;;;(H3,1,2,3,4);;;/q+3;+1;;;-4;;
InChIKeyUENNVAQEKNKKMW-UHFFFAOYSA-N
MW416.23 g/mol
LogP-8.15
Rot. Bonds

About aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate

aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate (PubChem CID 173350451) has the molecular formula H3AlKMoO8PS2Si and a molecular weight of 416.23 g/mol. Its IUPAC name is aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate.

Molecular Properties

Compound Namealuminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate
PubChem CID173350451
Molecular FormulaH3AlKMoO8PS2Si
Molecular Weight416.23 g/mol
Exact Mass417.73
IUPAC Namealuminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate
SMILESO=P(O)(O)O.S=[Mo]=S.[Al+3].[K+].[O-][Si]([O-])([O-])[O-]
InChIInChI=1S/Al.K.Mo.H3O4P.O4Si.2S/c;;;2*1-5(2,3)4;;/h;;;(H3,1,2,3,4);;;/q+3;+1;;;-4;;
InChIKeyUENNVAQEKNKKMW-UHFFFAOYSA-N
XLogP-8.15
TPSA170.00 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.23
LogP ≤ 5-8.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

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CID 174663311
dipotassium;bis(dihydrogen phosphate);phosphoric acid
CID 19756002
decaaluminum;phosphoric acid;decaphosphate
CID 173424288
dipotassium;hydride;phosphoric acid
CID 174834732
oxoniobium;phosphoric acid
CID 174337066
aluminum;hydron;phosphoric acid
CID 173045384
potassium;hydride;phosphoric acid
CID 173080125
dipotassium;hydron;phosphoric acid
CID 173015576
dipotassium;trisodium;phosphoric acid
CID 175728494
potassium;phosphoric acid;iodide
CID 162151776
diazanium;potassium;phosphoric acid;phosphate
CID 172814489
calcium;disodium;hydroxy(trioxido)silane;phosphoric acid;hydroxide
CID 175303842

Frequently Asked Questions

What is the IUPAC name of aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate?
The IUPAC name of aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate (CID 173350451) is aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate.
What is the SMILES notation for aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate?
The canonical SMILES for aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate is O=P(O)(O)O.S=[Mo]=S.[Al+3].[K+].[O-][Si]([O-])([O-])[O-].
What is the InChIKey of aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate?
The InChIKey is UENNVAQEKNKKMW-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.K.Mo.H3O4P.O4Si.2S/c;;;2*1-5(2,3)4;;/h;;;(H3,1,2,3,4);;;/q+3;+1;;;-4;;.
What are the key properties of aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate?
aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate has a molecular weight of 416.23 g/mol, XLogP of -8.15, 0 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;potassium;bis(sulfanylidene)molybdenum;phosphoric acid;silicate is sourced from PubChem (CID 173350451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).