copper;methanolate;nitrate

CH3Cu2NO4-2 — CID 173307085

IUPACcopper;methanolate;nitrate
SMILESC[O-].O=[N+]([O-])[O-].[Cu].[Cu]
InChIInChI=1S/CH3O.2Cu.NO3/c1-2;;;2-1(3)4/h1H3;;;/q-1;;;-1
InChIKeyZCXVMYNWIKAWCC-UHFFFAOYSA-N
MW220.13 g/mol
LogP-1.27
Rot. Bonds

About copper;methanolate;nitrate

copper;methanolate;nitrate (PubChem CID 173307085) has the molecular formula CH3Cu2NO4-2 and a molecular weight of 220.13 g/mol. Its IUPAC name is copper;methanolate;nitrate.

Molecular Properties

Compound Namecopper;methanolate;nitrate
PubChem CID173307085
Molecular FormulaCH3Cu2NO4-2
Molecular Weight220.13 g/mol
Exact Mass218.87
IUPAC Namecopper;methanolate;nitrate
SMILESC[O-].O=[N+]([O-])[O-].[Cu].[Cu]
InChIInChI=1S/CH3O.2Cu.NO3/c1-2;;;2-1(3)4/h1H3;;;/q-1;;;-1
InChIKeyZCXVMYNWIKAWCC-UHFFFAOYSA-N
XLogP-1.27
TPSA89.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.13
LogP ≤ 5-1.27
H-Bond Donors ≤ 50
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'}

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Frequently Asked Questions

What is the IUPAC name of copper;methanolate;nitrate?
The IUPAC name of copper;methanolate;nitrate (CID 173307085) is copper;methanolate;nitrate.
What is the SMILES notation for copper;methanolate;nitrate?
The canonical SMILES for copper;methanolate;nitrate is C[O-].O=[N+]([O-])[O-].[Cu].[Cu].
What is the InChIKey of copper;methanolate;nitrate?
The InChIKey is ZCXVMYNWIKAWCC-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3O.2Cu.NO3/c1-2;;;2-1(3)4/h1H3;;;/q-1;;;-1.
What are the key properties of copper;methanolate;nitrate?
copper;methanolate;nitrate has a molecular weight of 220.13 g/mol, XLogP of -1.27, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper;methanolate;nitrate is sourced from PubChem (CID 173307085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).