phosphoric acid;sulfanylidenemolybdenum;hydrate

H5MoO5PS — CID 174493465

IUPACphosphoric acid;sulfanylidenemolybdenum;hydrate
SMILESO.O=P(O)(O)O.S=[Mo]
InChIInChI=1S/Mo.H3O4P.H2O.S/c;1-5(2,3)4;;/h;(H3,1,2,3,4);1H2;
InChIKeyQFKIGFLZSHBKNJ-UHFFFAOYSA-N
MW244.02 g/mol
LogP-1.11
Rot. Bonds

About phosphoric acid;sulfanylidenemolybdenum;hydrate

phosphoric acid;sulfanylidenemolybdenum;hydrate (PubChem CID 174493465) has the molecular formula H5MoO5PS and a molecular weight of 244.02 g/mol. Its IUPAC name is phosphoric acid;sulfanylidenemolybdenum;hydrate.

Molecular Properties

Compound Namephosphoric acid;sulfanylidenemolybdenum;hydrate
PubChem CID174493465
Molecular FormulaH5MoO5PS
Molecular Weight244.02 g/mol
Exact Mass245.86
IUPAC Namephosphoric acid;sulfanylidenemolybdenum;hydrate
SMILESO.O=P(O)(O)O.S=[Mo]
InChIInChI=1S/Mo.H3O4P.H2O.S/c;1-5(2,3)4;;/h;(H3,1,2,3,4);1H2;
InChIKeyQFKIGFLZSHBKNJ-UHFFFAOYSA-N
XLogP-1.11
TPSA109.26 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.02
LogP ≤ 5-1.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phosphoric acid;sulfanylidenemolybdenum;hydrate?
The IUPAC name of phosphoric acid;sulfanylidenemolybdenum;hydrate (CID 174493465) is phosphoric acid;sulfanylidenemolybdenum;hydrate.
What is the SMILES notation for phosphoric acid;sulfanylidenemolybdenum;hydrate?
The canonical SMILES for phosphoric acid;sulfanylidenemolybdenum;hydrate is O.O=P(O)(O)O.S=[Mo].
What is the InChIKey of phosphoric acid;sulfanylidenemolybdenum;hydrate?
The InChIKey is QFKIGFLZSHBKNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/Mo.H3O4P.H2O.S/c;1-5(2,3)4;;/h;(H3,1,2,3,4);1H2;.
What are the key properties of phosphoric acid;sulfanylidenemolybdenum;hydrate?
phosphoric acid;sulfanylidenemolybdenum;hydrate has a molecular weight of 244.02 g/mol, XLogP of -1.11, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phosphoric acid;sulfanylidenemolybdenum;hydrate is sourced from PubChem (CID 174493465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).