cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine

C2H4CoN2O2 — CID 174050213

IUPACcobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine
SMILESO/N=C/C=N/O.[Co]
InChIInChI=1S/C2H4N2O2.Co/c5-3-1-2-4-6;/h1-2,5-6H;/b3-1+,4-2+;
InChIKeyGMTZHYBIXXOBHP-LMFJUDGVSA-N
MW147.00 g/mol
LogP-0.10
Rot. Bonds1

About cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine

cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine (PubChem CID 174050213) has the molecular formula C2H4CoN2O2 and a molecular weight of 147.00 g/mol. Its IUPAC name is cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine.

Molecular Properties

Compound Namecobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine
PubChem CID174050213
Molecular FormulaC2H4CoN2O2
Molecular Weight147.00 g/mol
Exact Mass146.96
IUPAC Namecobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine
SMILESO/N=C/C=N/O.[Co]
InChIInChI=1S/C2H4N2O2.Co/c5-3-1-2-4-6;/h1-2,5-6H;/b3-1+,4-2+;
InChIKeyGMTZHYBIXXOBHP-LMFJUDGVSA-N
XLogP-0.10
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.00
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', '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 cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine?
The IUPAC name of cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine (CID 174050213) is cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine.
What is the SMILES notation for cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine?
The canonical SMILES for cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine is O/N=C/C=N/O.[Co].
What is the InChIKey of cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine?
The InChIKey is GMTZHYBIXXOBHP-LMFJUDGVSA-N. The full InChI is InChI=1S/C2H4N2O2.Co/c5-3-1-2-4-6;/h1-2,5-6H;/b3-1+,4-2+;.
What are the key properties of cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine?
cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine has a molecular weight of 147.00 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;(NE)-N-[(2E)-2-hydroxyiminoethylidene]hydroxylamine is sourced from PubChem (CID 174050213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).