copper phosphono dihydrogen phosphate

H4CuO7P2+2 — CID 24940

IUPACcopper phosphono dihydrogen phosphate
SMILESO=P(O)(O)OP(=O)(O)O.[Cu+2]
InChIInChI=1S/Cu.H4O7P2/c;1-8(2,3)7-9(4,5)6/h;(H2,1,2,3)(H2,4,5,6)/q+2;
InChIKeyLCSAYGBGVLEKPO-UHFFFAOYSA-N
MW241.52 g/mol
LogP-0.81
Rot. Bonds2

About copper phosphono dihydrogen phosphate

copper phosphono dihydrogen phosphate (PubChem CID 24940) has the molecular formula H4CuO7P2+2 and a molecular weight of 241.52 g/mol. Its IUPAC name is copper phosphono dihydrogen phosphate.

Molecular Properties

Compound Namecopper phosphono dihydrogen phosphate
PubChem CID24940
Molecular FormulaH4CuO7P2+2
Molecular Weight241.52 g/mol
Exact Mass240.87
IUPAC Namecopper phosphono dihydrogen phosphate
SMILESO=P(O)(O)OP(=O)(O)O.[Cu+2]
InChIInChI=1S/Cu.H4O7P2/c;1-8(2,3)7-9(4,5)6/h;(H2,1,2,3)(H2,4,5,6)/q+2;
InChIKeyLCSAYGBGVLEKPO-UHFFFAOYSA-N
XLogP-0.81
TPSA124.29 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.52
LogP ≤ 5-0.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Pyrophosphoric acid
CID 1023
Hydron;phosphono phosphate
CID 173008659
Cupric phosphate trihydrate
CID 71586933
CuH4O7P2
CID 161024566
Pyrophosphorsaure
CID 16160854
Copper bis(dihydrogen phosphate)
CID 13879485
Cupric pyrophosphate trihydrate
CID 91886264
Cupric pyrophosphate tetrahydrate
CID 91886265
Cupric pyrophosphate dihydrate
CID 119026003
Copper(2+) dihydrogen diphosphate
CID 138394178
Copper phosphono phosphate
CID 169502055
Kupferpyrophosphat
CID 129636190

Frequently Asked Questions

What is the IUPAC name of copper phosphono dihydrogen phosphate?
The IUPAC name of copper phosphono dihydrogen phosphate (CID 24940) is copper phosphono dihydrogen phosphate.
What is the SMILES notation for copper phosphono dihydrogen phosphate?
The canonical SMILES for copper phosphono dihydrogen phosphate is O=P(O)(O)OP(=O)(O)O.[Cu+2].
What is the InChIKey of copper phosphono dihydrogen phosphate?
The InChIKey is LCSAYGBGVLEKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/Cu.H4O7P2/c;1-8(2,3)7-9(4,5)6/h;(H2,1,2,3)(H2,4,5,6)/q+2;.
What are the key properties of copper phosphono dihydrogen phosphate?
copper phosphono dihydrogen phosphate has a molecular weight of 241.52 g/mol, XLogP of -0.81, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for copper phosphono dihydrogen phosphate is sourced from PubChem (CID 24940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).