dioxidanium;bis(2-hydroxyacetic acid);manganese

C4H14MnO8+2 — CID 5232950

IUPACdioxidanium;bis(2-hydroxyacetic acid);manganese
SMILESO=C(O)CO.O=C(O)CO.[Mn].[OH3+].[OH3+]
InChIInChI=1S/2C2H4O3.Mn.2H2O/c2*3-1-2(4)5;;;/h2*3H,1H2,(H,4,5);;2*1H2/p+2
InChIKeySZDSAWAUMVCYDE-UHFFFAOYSA-P
MW245.09 g/mol
LogP-3.72
Rot. Bonds2

About dioxidanium;bis(2-hydroxyacetic acid);manganese

dioxidanium;bis(2-hydroxyacetic acid);manganese (PubChem CID 5232950) has the molecular formula C4H14MnO8+2 and a molecular weight of 245.09 g/mol. Its IUPAC name is dioxidanium;bis(2-hydroxyacetic acid);manganese.

Molecular Properties

Compound Namedioxidanium;bis(2-hydroxyacetic acid);manganese
PubChem CID5232950
Molecular FormulaC4H14MnO8+2
Molecular Weight245.09 g/mol
Exact Mass245.01
IUPAC Namedioxidanium;bis(2-hydroxyacetic acid);manganese
SMILESO=C(O)CO.O=C(O)CO.[Mn].[OH3+].[OH3+]
InChIInChI=1S/2C2H4O3.Mn.2H2O/c2*3-1-2(4)5;;;/h2*3H,1H2,(H,4,5);;2*1H2/p+2
InChIKeySZDSAWAUMVCYDE-UHFFFAOYSA-P
XLogP-3.72
TPSA181.06 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.09
LogP ≤ 5-3.72
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

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Related Compounds

tetrakis(2-hydroxyacetic acid);silane
CID 173225780
bis(2-hydroxyacetic acid);methane
CID 158039555
CID 88684247
CID 88684247
azane;2-hydroxyacetic acid;zirconium
CID 173458110
benzene;2-hydroxyacetic acid
CID 67764636
2-hydroxyacetic acid;silane;zirconium
CID 174940076
heptakis(2-hydroxyacetic acid);yttrium;zirconium
CID 154733245
acetylene;2-hydroxyacetic acid
CID 158693227
ethane-1,2-diol;2-hydroxyacetic acid;stibane
CID 174707857
2-hydroxyacetic acid;sulfurous acid
CID 87280138
2-hydroxyacetic acid;phosphoric acid
CID 23322415
2-hydroxyacetic acid;methoxymethane
CID 87581490

Frequently Asked Questions

What is the IUPAC name of dioxidanium;bis(2-hydroxyacetic acid);manganese?
The IUPAC name of dioxidanium;bis(2-hydroxyacetic acid);manganese (CID 5232950) is dioxidanium;bis(2-hydroxyacetic acid);manganese.
What is the SMILES notation for dioxidanium;bis(2-hydroxyacetic acid);manganese?
The canonical SMILES for dioxidanium;bis(2-hydroxyacetic acid);manganese is O=C(O)CO.O=C(O)CO.[Mn].[OH3+].[OH3+].
What is the InChIKey of dioxidanium;bis(2-hydroxyacetic acid);manganese?
The InChIKey is SZDSAWAUMVCYDE-UHFFFAOYSA-P. The full InChI is InChI=1S/2C2H4O3.Mn.2H2O/c2*3-1-2(4)5;;;/h2*3H,1H2,(H,4,5);;2*1H2/p+2.
What are the key properties of dioxidanium;bis(2-hydroxyacetic acid);manganese?
dioxidanium;bis(2-hydroxyacetic acid);manganese has a molecular weight of 245.09 g/mol, XLogP of -3.72, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dioxidanium;bis(2-hydroxyacetic acid);manganese is sourced from PubChem (CID 5232950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).