manganese(2+);2-oxopropanoic acid

C3H4MnO3+2 — CID 162367990

IUPACmanganese(2+);2-oxopropanoic acid
SMILESCC(=O)C(=O)O.[Mn+2]
InChIInChI=1S/C3H4O3.Mn/c1-2(4)3(5)6;/h1H3,(H,5,6);/q;+2
InChIKeyZUOVEEXYLVZTHV-UHFFFAOYSA-N
MW143.00 g/mol
LogP-0.34
Rot. Bonds1

About manganese(2+);2-oxopropanoic acid

manganese(2+);2-oxopropanoic acid (PubChem CID 162367990) has the molecular formula C3H4MnO3+2 and a molecular weight of 143.00 g/mol. Its IUPAC name is manganese(2+);2-oxopropanoic acid.

Molecular Properties

Compound Namemanganese(2+);2-oxopropanoic acid
PubChem CID162367990
Molecular FormulaC3H4MnO3+2
Molecular Weight143.00 g/mol
Exact Mass142.95
IUPAC Namemanganese(2+);2-oxopropanoic acid
SMILESCC(=O)C(=O)O.[Mn+2]
InChIInChI=1S/C3H4O3.Mn/c1-2(4)3(5)6;/h1H3,(H,5,6);/q;+2
InChIKeyZUOVEEXYLVZTHV-UHFFFAOYSA-N
XLogP-0.34
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.00
LogP ≤ 5-0.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

strontium 2-oxopropanoic acid
CID 10154276
CID 131870939
CID 131870939
iridium;2-oxopropanoic acid
CID 174870791
sodium;2-oxopropanoic acid;chloride
CID 173324944
2-oxopropanoic acid;titanium;zirconium
CID 174908427
ethanol;bis(2-oxopropanoic acid)
CID 159682391
trilithium;bis(2-oxopropanoic acid);borate
CID 175964793
butane-2,3-dione;carbonic acid
CID 174891727
sodium;hydride;2-oxopropanoic acid;selenous acid
CID 173349009
acetyl acetate;2-oxopropanoic acid;vanadium
CID 174449179
bromo(trifluoro)methane;2-oxopropanoic acid
CID 174527725
acetic acid
CID 158444727

Frequently Asked Questions

What is the IUPAC name of manganese(2+);2-oxopropanoic acid?
The IUPAC name of manganese(2+);2-oxopropanoic acid (CID 162367990) is manganese(2+);2-oxopropanoic acid.
What is the SMILES notation for manganese(2+);2-oxopropanoic acid?
The canonical SMILES for manganese(2+);2-oxopropanoic acid is CC(=O)C(=O)O.[Mn+2].
What is the InChIKey of manganese(2+);2-oxopropanoic acid?
The InChIKey is ZUOVEEXYLVZTHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4O3.Mn/c1-2(4)3(5)6;/h1H3,(H,5,6);/q;+2.
What are the key properties of manganese(2+);2-oxopropanoic acid?
manganese(2+);2-oxopropanoic acid has a molecular weight of 143.00 g/mol, XLogP of -0.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for manganese(2+);2-oxopropanoic acid is sourced from PubChem (CID 162367990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).