hydroperoxymethane;nickel

CH4NiO2 — CID 59168075

IUPAChydroperoxymethane;nickel
SMILESCOO.[Ni]
InChIInChI=1S/CH4O2.Ni/c1-3-2;/h2H,1H3;
InChIKeyVUWLRUDZEKISAJ-UHFFFAOYSA-N
MW106.73 g/mol
LogP0.10
Rot. Bonds

About hydroperoxymethane;nickel

hydroperoxymethane;nickel (PubChem CID 59168075) has the molecular formula CH4NiO2 and a molecular weight of 106.73 g/mol. Its IUPAC name is hydroperoxymethane;nickel.

Molecular Properties

Compound Namehydroperoxymethane;nickel
PubChem CID59168075
Molecular FormulaCH4NiO2
Molecular Weight106.73 g/mol
Exact Mass105.96
IUPAC Namehydroperoxymethane;nickel
SMILESCOO.[Ni]
InChIInChI=1S/CH4O2.Ni/c1-3-2;/h2H,1H3;
InChIKeyVUWLRUDZEKISAJ-UHFFFAOYSA-N
XLogP0.10
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.73
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydroperoxymethane;nickel?
The IUPAC name of hydroperoxymethane;nickel (CID 59168075) is hydroperoxymethane;nickel.
What is the SMILES notation for hydroperoxymethane;nickel?
The canonical SMILES for hydroperoxymethane;nickel is COO.[Ni].
What is the InChIKey of hydroperoxymethane;nickel?
The InChIKey is VUWLRUDZEKISAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O2.Ni/c1-3-2;/h2H,1H3;.
What are the key properties of hydroperoxymethane;nickel?
hydroperoxymethane;nickel has a molecular weight of 106.73 g/mol, XLogP of 0.10, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroperoxymethane;nickel is sourced from PubChem (CID 59168075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).