bis(2-aminoguanidine);cobalt(2+);diperchlorate

C2H12Cl2CoN8O8 — CID 173077202

IUPACbis(2-aminoguanidine);cobalt(2+);diperchlorate
SMILESNN=C(N)N.NN=C(N)N.[Co+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/2CH6N4.2ClHO4.Co/c2*2-1(3)5-4;2*2-1(3,4)5;/h2*4H2,(H4,2,3,5);2*(H,2,3,4,5);/q;;;;+2/p-2
InChIKeyXEWZETOFLABNQN-UHFFFAOYSA-L
MW406.01 g/mol
LogP-13.25
Rot. Bonds

About bis(2-aminoguanidine);cobalt(2+);diperchlorate

bis(2-aminoguanidine);cobalt(2+);diperchlorate (PubChem CID 173077202) has the molecular formula C2H12Cl2CoN8O8 and a molecular weight of 406.01 g/mol. Its IUPAC name is bis(2-aminoguanidine);cobalt(2+);diperchlorate.

Molecular Properties

Compound Namebis(2-aminoguanidine);cobalt(2+);diperchlorate
PubChem CID173077202
Molecular FormulaC2H12Cl2CoN8O8
Molecular Weight406.01 g/mol
Exact Mass404.95
IUPAC Namebis(2-aminoguanidine);cobalt(2+);diperchlorate
SMILESNN=C(N)N.NN=C(N)N.[Co+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-]
InChIInChI=1S/2CH6N4.2ClHO4.Co/c2*2-1(3)5-4;2*2-1(3,4)5;/h2*4H2,(H4,2,3,5);2*(H,2,3,4,5);/q;;;;+2/p-2
InChIKeyXEWZETOFLABNQN-UHFFFAOYSA-L
XLogP-13.25
TPSA365.32 Ų
H-Bond Donors6
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500406.01
LogP ≤ 5-13.25
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', '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 bis(2-aminoguanidine);cobalt(2+);diperchlorate?
The IUPAC name of bis(2-aminoguanidine);cobalt(2+);diperchlorate (CID 173077202) is bis(2-aminoguanidine);cobalt(2+);diperchlorate.
What is the SMILES notation for bis(2-aminoguanidine);cobalt(2+);diperchlorate?
The canonical SMILES for bis(2-aminoguanidine);cobalt(2+);diperchlorate is NN=C(N)N.NN=C(N)N.[Co+2].[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].
What is the InChIKey of bis(2-aminoguanidine);cobalt(2+);diperchlorate?
The InChIKey is XEWZETOFLABNQN-UHFFFAOYSA-L. The full InChI is InChI=1S/2CH6N4.2ClHO4.Co/c2*2-1(3)5-4;2*2-1(3,4)5;/h2*4H2,(H4,2,3,5);2*(H,2,3,4,5);/q;;;;+2/p-2.
What are the key properties of bis(2-aminoguanidine);cobalt(2+);diperchlorate?
bis(2-aminoguanidine);cobalt(2+);diperchlorate has a molecular weight of 406.01 g/mol, XLogP of -13.25, 0 rotatable bonds, 6 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-aminoguanidine);cobalt(2+);diperchlorate is sourced from PubChem (CID 173077202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).