cobalt;dioxirane-3,3-diol;manganese

CH2CoMn2O4 — CID 174678591

IUPACcobalt;dioxirane-3,3-diol;manganese
SMILESOC1(O)OO1.[Co].[Mn].[Mn]
InChIInChI=1S/CH2O4.Co.2Mn/c2-1(3)4-5-1;;;/h2-3H;;;
InChIKeyNSBMZJJKSVALSO-UHFFFAOYSA-N
MW246.83 g/mol
LogP-1.46
Rot. Bonds

About cobalt;dioxirane-3,3-diol;manganese

cobalt;dioxirane-3,3-diol;manganese (PubChem CID 174678591) has the molecular formula CH2CoMn2O4 and a molecular weight of 246.83 g/mol. Its IUPAC name is cobalt;dioxirane-3,3-diol;manganese.

Molecular Properties

Compound Namecobalt;dioxirane-3,3-diol;manganese
PubChem CID174678591
Molecular FormulaCH2CoMn2O4
Molecular Weight246.83 g/mol
Exact Mass246.80
IUPAC Namecobalt;dioxirane-3,3-diol;manganese
SMILESOC1(O)OO1.[Co].[Mn].[Mn]
InChIInChI=1S/CH2O4.Co.2Mn/c2-1(3)4-5-1;;;/h2-3H;;;
InChIKeyNSBMZJJKSVALSO-UHFFFAOYSA-N
XLogP-1.46
TPSA65.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.83
LogP ≤ 5-1.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

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1,3,5-trioxane-2,2,4,4,6,6-hexol
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alumane;3-hydroperoxydioxiran-3-ol
CID 175238595
azane;3-methoxydioxiran-3-ol
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lanthanum;3-methoxydioxiran-3-ol
CID 175608723
6-tert-butyl-1-oxaspiro[3.3]heptan-6-ol
CID 172542205
3-methyl-2,4-dioxabicyclo[1.1.0]butan-1-ol
CID 173021166
3,3-dimethyldioxolane-4,4-diol
CID 19069932
4-chloro-4-hydroxydioxetan-3-one
CID 102161112
cobalt;manganese;nickel;oxomanganese
CID 175581890

Frequently Asked Questions

What is the IUPAC name of cobalt;dioxirane-3,3-diol;manganese?
The IUPAC name of cobalt;dioxirane-3,3-diol;manganese (CID 174678591) is cobalt;dioxirane-3,3-diol;manganese.
What is the SMILES notation for cobalt;dioxirane-3,3-diol;manganese?
The canonical SMILES for cobalt;dioxirane-3,3-diol;manganese is OC1(O)OO1.[Co].[Mn].[Mn].
What is the InChIKey of cobalt;dioxirane-3,3-diol;manganese?
The InChIKey is NSBMZJJKSVALSO-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O4.Co.2Mn/c2-1(3)4-5-1;;;/h2-3H;;;.
What are the key properties of cobalt;dioxirane-3,3-diol;manganese?
cobalt;dioxirane-3,3-diol;manganese has a molecular weight of 246.83 g/mol, XLogP of -1.46, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;dioxirane-3,3-diol;manganese is sourced from PubChem (CID 174678591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).