copper(1+);dichlorocopper;nitric acid;acetate

C2H4Cl2Cu2NO5 — CID 174897354

IUPACcopper(1+);dichlorocopper;nitric acid;acetate
SMILESCC(=O)[O-].Cl[Cu]Cl.O=[N+]([O-])O.[Cu+]
InChIInChI=1S/C2H4O2.2ClH.2Cu.HNO3/c1-2(3)4;;;;;2-1(3)4/h1H3,(H,3,4);2*1H;;;(H,2,3,4)/q;;;+1;+2;/p-3
InChIKeySECSULKZBIBGSS-UHFFFAOYSA-K
MW320.05 g/mol
LogP-0.22
Rot. Bonds

About copper(1+);dichlorocopper;nitric acid;acetate

copper(1+);dichlorocopper;nitric acid;acetate (PubChem CID 174897354) has the molecular formula C2H4Cl2Cu2NO5 and a molecular weight of 320.05 g/mol. Its IUPAC name is copper(1+);dichlorocopper;nitric acid;acetate.

Molecular Properties

Compound Namecopper(1+);dichlorocopper;nitric acid;acetate
PubChem CID174897354
Molecular FormulaC2H4Cl2Cu2NO5
Molecular Weight320.05 g/mol
Exact Mass317.81
IUPAC Namecopper(1+);dichlorocopper;nitric acid;acetate
SMILESCC(=O)[O-].Cl[Cu]Cl.O=[N+]([O-])O.[Cu+]
InChIInChI=1S/C2H4O2.2ClH.2Cu.HNO3/c1-2(3)4;;;;;2-1(3)4/h1H3,(H,3,4);2*1H;;;(H,2,3,4)/q;;;+1;+2;/p-3
InChIKeySECSULKZBIBGSS-UHFFFAOYSA-K
XLogP-0.22
TPSA103.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.05
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze copper(1+);dichlorocopper;nitric acid;acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

nitric acid;bis(ruthenium(3+));hexaacetate
CID 172717903
potassium;dichlorocopper;acetate
CID 87846781
calcium;acetate;nitrate
CID 175242971
bis(cerium(3+));acetate;nitrate
CID 22023657
azanium;sodium;acetate;nitrate
CID 141287882
cadmium(2+);acetate;chloride
CID 160756962
copper(1+);acetate;hydroiodide
CID 175324821
bis(cadmium(2+));acetate;bromide
CID 172734045
cobalt;copper(1+);acetate
CID 174928314
hydrazine;silver;acetate;nitrate
CID 175333281
potassium;sodium;acetate;nitrate;trihydrate
CID 171618284
azanide;2-chloroacetate;cobalt(3+);nitric acid
CID 54603513

Frequently Asked Questions

What is the IUPAC name of copper(1+);dichlorocopper;nitric acid;acetate?
The IUPAC name of copper(1+);dichlorocopper;nitric acid;acetate (CID 174897354) is copper(1+);dichlorocopper;nitric acid;acetate.
What is the SMILES notation for copper(1+);dichlorocopper;nitric acid;acetate?
The canonical SMILES for copper(1+);dichlorocopper;nitric acid;acetate is CC(=O)[O-].Cl[Cu]Cl.O=[N+]([O-])O.[Cu+].
What is the InChIKey of copper(1+);dichlorocopper;nitric acid;acetate?
The InChIKey is SECSULKZBIBGSS-UHFFFAOYSA-K. The full InChI is InChI=1S/C2H4O2.2ClH.2Cu.HNO3/c1-2(3)4;;;;;2-1(3)4/h1H3,(H,3,4);2*1H;;;(H,2,3,4)/q;;;+1;+2;/p-3.
What are the key properties of copper(1+);dichlorocopper;nitric acid;acetate?
copper(1+);dichlorocopper;nitric acid;acetate has a molecular weight of 320.05 g/mol, XLogP of -0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);dichlorocopper;nitric acid;acetate is sourced from PubChem (CID 174897354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).