cobalt(2+);dinitrate;hydrate

H2CoN2O7 — CID 45051618

IUPACcobalt(2+);dinitrate;hydrate
SMILESO.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Co+2]
InChIInChI=1S/Co.2NO3.H2O/c;2*2-1(3)4;/h;;;1H2/q+2;2*-1;
InChIKeyXZXAIFLKPKVPLO-UHFFFAOYSA-N
MW200.96 g/mol
LogP-1.31
Rot. Bonds

About cobalt(2+);dinitrate;hydrate

cobalt(2+);dinitrate;hydrate (PubChem CID 45051618) has the molecular formula H2CoN2O7 and a molecular weight of 200.96 g/mol. Its IUPAC name is cobalt(2+);dinitrate;hydrate.

Molecular Properties

Compound Namecobalt(2+);dinitrate;hydrate
PubChem CID45051618
Molecular FormulaH2CoN2O7
Molecular Weight200.96 g/mol
Exact Mass200.92
IUPAC Namecobalt(2+);dinitrate;hydrate
SMILESO.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Co+2]
InChIInChI=1S/Co.2NO3.H2O/c;2*2-1(3)4;/h;;;1H2/q+2;2*-1;
InChIKeyXZXAIFLKPKVPLO-UHFFFAOYSA-N
XLogP-1.31
TPSA163.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.96
LogP ≤ 5-1.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze cobalt(2+);dinitrate;hydrate with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cobalt(2+);dinitrate;hydrate?
The IUPAC name of cobalt(2+);dinitrate;hydrate (CID 45051618) is cobalt(2+);dinitrate;hydrate.
What is the SMILES notation for cobalt(2+);dinitrate;hydrate?
The canonical SMILES for cobalt(2+);dinitrate;hydrate is O.O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Co+2].
What is the InChIKey of cobalt(2+);dinitrate;hydrate?
The InChIKey is XZXAIFLKPKVPLO-UHFFFAOYSA-N. The full InChI is InChI=1S/Co.2NO3.H2O/c;2*2-1(3)4;/h;;;1H2/q+2;2*-1;.
What are the key properties of cobalt(2+);dinitrate;hydrate?
cobalt(2+);dinitrate;hydrate has a molecular weight of 200.96 g/mol, XLogP of -1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt(2+);dinitrate;hydrate is sourced from PubChem (CID 45051618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).