molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate

MoO10P3-5 — CID 161385249

IUPACmolybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate
SMILESO=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Mo]
InChIInChI=1S/Mo.H5O10P3/c;1-11(2,3)9-13(7,8)10-12(4,5)6/h;(H,7,8)(H2,1,2,3)(H2,4,5,6)/p-5
InChIKeyZHNDKXAPMBEGAO-UHFFFAOYSA-I
MW348.85 g/mol
LogP-3.86
Rot. Bonds4

About molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate

molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate (PubChem CID 161385249) has the molecular formula MoO10P3-5 and a molecular weight of 348.85 g/mol. Its IUPAC name is molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate.

Molecular Properties

Compound Namemolybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate
PubChem CID161385249
Molecular FormulaMoO10P3-5
Molecular Weight348.85 g/mol
Exact Mass350.78
IUPAC Namemolybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate
SMILESO=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Mo]
InChIInChI=1S/Mo.H5O10P3/c;1-11(2,3)9-13(7,8)10-12(4,5)6/h;(H,7,8)(H2,1,2,3)(H2,4,5,6)/p-5
InChIKeyZHNDKXAPMBEGAO-UHFFFAOYSA-I
XLogP-3.86
TPSA184.97 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.85
LogP ≤ 5-3.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate?
The IUPAC name of molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate (CID 161385249) is molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate.
What is the SMILES notation for molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate?
The canonical SMILES for molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate is O=P([O-])([O-])OP(=O)([O-])OP(=O)([O-])[O-].[Mo].
What is the InChIKey of molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate?
The InChIKey is ZHNDKXAPMBEGAO-UHFFFAOYSA-I. The full InChI is InChI=1S/Mo.H5O10P3/c;1-11(2,3)9-13(7,8)10-12(4,5)6/h;(H,7,8)(H2,1,2,3)(H2,4,5,6)/p-5.
What are the key properties of molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate?
molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate has a molecular weight of 348.85 g/mol, XLogP of -3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for molybdenum;[oxido(phosphonatooxy)phosphoryl] phosphate is sourced from PubChem (CID 161385249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).