chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate

H5CrO14P4 — CID 175898917

IUPACchromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate
SMILESO=P(O)(O)OP(=O)(O)O.O=P([O-])([O-])OP(=O)([O-])O.[Cr+3]
InChIInChI=1S/Cr.2H4O7P2/c;2*1-8(2,3)7-9(4,5)6/h;2*(H2,1,2,3)(H2,4,5,6)/q+3;;/p-3
InChIKeySUSLDZZOABWYHF-UHFFFAOYSA-K
MW404.92 g/mol
LogP-3.52
Rot. Bonds4

About chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate

chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate (PubChem CID 175898917) has the molecular formula H5CrO14P4 and a molecular weight of 404.92 g/mol. Its IUPAC name is chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate.

Molecular Properties

Compound Namechromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate
PubChem CID175898917
Molecular FormulaH5CrO14P4
Molecular Weight404.92 g/mol
Exact Mass404.80
IUPAC Namechromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate
SMILESO=P(O)(O)OP(=O)(O)O.O=P([O-])([O-])OP(=O)([O-])O.[Cr+3]
InChIInChI=1S/Cr.2H4O7P2/c;2*1-8(2,3)7-9(4,5)6/h;2*(H2,1,2,3)(H2,4,5,6)/q+3;;/p-3
InChIKeySUSLDZZOABWYHF-UHFFFAOYSA-K
XLogP-3.52
TPSA257.07 Ų
H-Bond Donors5
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.92
LogP ≤ 5-3.52
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

trisodium;[hydroxy(oxido)phosphoryl] phosphate;dodecahydrate
CID 158298234
disodium;phosphono dihydrogen phosphate;phosphono phosphate
CID 173430814
disodium;hydron;[hydroxy(oxido)phosphoryl] phosphate
CID 173017843
phosphono phosphate
CID 57345951
lithium;[hydroxy(oxido)phosphoryl] phosphate;iron(2+);phosphoric acid
CID 174059070
sodium;azane;phosphono hydrogen phosphate;tetrahydrate
CID 174651313
cesium phosphono hydrogen phosphate
CID 160778064
manganese(2+);phosphono phosphate
CID 138395841
potassium;disodium;dihydrogen phosphate;phosphono hydrogen phosphate;chloride
CID 174949441
copper;phosphono hydrogen phosphate;chloride
CID 175231033
disodium;ethane;phosphono phosphate
CID 19985246
potassium;sodium;[hydroxy(phosphonooxy)phosphoryl] hydrogen phosphate;hydroxide
CID 172800352

Frequently Asked Questions

What is the IUPAC name of chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate?
The IUPAC name of chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate (CID 175898917) is chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate.
What is the SMILES notation for chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate?
The canonical SMILES for chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate is O=P(O)(O)OP(=O)(O)O.O=P([O-])([O-])OP(=O)([O-])O.[Cr+3].
What is the InChIKey of chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate?
The InChIKey is SUSLDZZOABWYHF-UHFFFAOYSA-K. The full InChI is InChI=1S/Cr.2H4O7P2/c;2*1-8(2,3)7-9(4,5)6/h;2*(H2,1,2,3)(H2,4,5,6)/q+3;;/p-3.
What are the key properties of chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate?
chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate has a molecular weight of 404.92 g/mol, XLogP of -3.52, 4 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for chromium(3+);[hydroxy(oxido)phosphoryl] phosphate;phosphono dihydrogen phosphate is sourced from PubChem (CID 175898917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).