copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate

C4H20CuN4O6W — CID 138319506

IUPACcopper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate
SMILESNCCN.NCCN.O.O.O=[W](=O)([O-])[O-].[Cu+2]
InChIInChI=1S/2C2H8N2.Cu.2H2O.4O.W/c2*3-1-2-4;;;;;;;;/h2*1-4H2;;2*1H2;;;;;/q;;+2;;;;;2*-1;
InChIKeyLUVCQVSGOMWEDL-UHFFFAOYSA-N
MW467.61 g/mol
LogP-6.46
Rot. Bonds2

About copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate

copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate (PubChem CID 138319506) has the molecular formula C4H20CuN4O6W and a molecular weight of 467.61 g/mol. Its IUPAC name is copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate.

Molecular Properties

Compound Namecopper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate
PubChem CID138319506
Molecular FormulaC4H20CuN4O6W
Molecular Weight467.61 g/mol
Exact Mass467.02
IUPAC Namecopper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate
SMILESNCCN.NCCN.O.O.O=[W](=O)([O-])[O-].[Cu+2]
InChIInChI=1S/2C2H8N2.Cu.2H2O.4O.W/c2*3-1-2-4;;;;;;;;/h2*1-4H2;;2*1H2;;;;;/q;;+2;;;;;2*-1;
InChIKeyLUVCQVSGOMWEDL-UHFFFAOYSA-N
XLogP-6.46
TPSA247.34 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.61
LogP ≤ 5-6.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate?
The IUPAC name of copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate (CID 138319506) is copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate.
What is the SMILES notation for copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate?
The canonical SMILES for copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate is NCCN.NCCN.O.O.O=[W](=O)([O-])[O-].[Cu+2].
What is the InChIKey of copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate?
The InChIKey is LUVCQVSGOMWEDL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H8N2.Cu.2H2O.4O.W/c2*3-1-2-4;;;;;;;;/h2*1-4H2;;2*1H2;;;;;/q;;+2;;;;;2*-1;.
What are the key properties of copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate?
copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate has a molecular weight of 467.61 g/mol, XLogP of -6.46, 2 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for copper;dioxido(dioxo)tungsten;bis(ethane-1,2-diamine);dihydrate is sourced from PubChem (CID 138319506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).