tris(dihydrogen phosphate);oxygen(2-);vanadium

H6O13P3V-5 — CID 53241738

IUPACtris(dihydrogen phosphate);oxygen(2-);vanadium
SMILESO=P([O-])(O)O.O=P([O-])(O)O.O=P([O-])(O)O.[O-2].[V]
InChIInChI=1S/3H3O4P.O.V/c3*1-5(2,3)4;;/h3*(H3,1,2,3,4);;/q;;;-2;/p-3
InChIKeyNLLBDETZVUPZDY-UHFFFAOYSA-K
MW357.90 g/mol
LogP-4.80
Rot. Bonds

About tris(dihydrogen phosphate);oxygen(2-);vanadium

tris(dihydrogen phosphate);oxygen(2-);vanadium (PubChem CID 53241738) has the molecular formula H6O13P3V-5 and a molecular weight of 357.90 g/mol. Its IUPAC name is tris(dihydrogen phosphate);oxygen(2-);vanadium.

Molecular Properties

Compound Nametris(dihydrogen phosphate);oxygen(2-);vanadium
PubChem CID53241738
Molecular FormulaH6O13P3V-5
Molecular Weight357.90 g/mol
Exact Mass357.85
IUPAC Nametris(dihydrogen phosphate);oxygen(2-);vanadium
SMILESO=P([O-])(O)O.O=P([O-])(O)O.O=P([O-])(O)O.[O-2].[V]
InChIInChI=1S/3H3O4P.O.V/c3*1-5(2,3)4;;/h3*(H3,1,2,3,4);;/q;;;-2;/p-3
InChIKeyNLLBDETZVUPZDY-UHFFFAOYSA-K
XLogP-4.80
TPSA270.27 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.90
LogP ≤ 5-4.80
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

dihydrogen phosphate;oxygen(2-);ytterbium(3+)
CID 158954698
azanium;zinc;dihydrogen phosphate;oxygen(2-)
CID 160778942
tetrakis(dihydrogen phosphate);zirconium(4+)
CID 22328152
dizinc;tetrakis(dihydrogen phosphate)
CID 161370337
tetrakis(dihydrogen phosphate);tetrakis(thallium(1+))
CID 139063709
zinc bis(dihydrogen phosphate)
CID 11253952
hexakis(dihydrogen phosphate);molybdenum
CID 18504359
sodium dihydroxy(32P)phosphinate
CID 23694678
azane;dihydrogen phosphate;hydron
CID 172995707
sodium;dihydrogen phosphate;pentahydrate
CID 141311131
lithium;dihydrogen phosphate;dihydrate
CID 162740177
dipotassium;bis(dihydrogen phosphate);phosphoric acid
CID 19756002

Frequently Asked Questions

What is the IUPAC name of tris(dihydrogen phosphate);oxygen(2-);vanadium?
The IUPAC name of tris(dihydrogen phosphate);oxygen(2-);vanadium (CID 53241738) is tris(dihydrogen phosphate);oxygen(2-);vanadium.
What is the SMILES notation for tris(dihydrogen phosphate);oxygen(2-);vanadium?
The canonical SMILES for tris(dihydrogen phosphate);oxygen(2-);vanadium is O=P([O-])(O)O.O=P([O-])(O)O.O=P([O-])(O)O.[O-2].[V].
What is the InChIKey of tris(dihydrogen phosphate);oxygen(2-);vanadium?
The InChIKey is NLLBDETZVUPZDY-UHFFFAOYSA-K. The full InChI is InChI=1S/3H3O4P.O.V/c3*1-5(2,3)4;;/h3*(H3,1,2,3,4);;/q;;;-2;/p-3.
What are the key properties of tris(dihydrogen phosphate);oxygen(2-);vanadium?
tris(dihydrogen phosphate);oxygen(2-);vanadium has a molecular weight of 357.90 g/mol, XLogP of -4.80, 0 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(dihydrogen phosphate);oxygen(2-);vanadium is sourced from PubChem (CID 53241738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).