tetrakis(2-hydroxypropanoic acid);manganese

C12H24Mn2O12 — CID 167442579

IUPACtetrakis(2-hydroxypropanoic acid);manganese
SMILESCC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)O.[Mn].[Mn]
InChIInChI=1S/4C3H6O3.2Mn/c4*1-2(4)3(5)6;;/h4*2,4H,1H3,(H,5,6);;
InChIKeyIMTHLZVLNWECPT-UHFFFAOYSA-N
MW470.19 g/mol
LogP-2.20
Rot. Bonds4

About tetrakis(2-hydroxypropanoic acid);manganese

tetrakis(2-hydroxypropanoic acid);manganese (PubChem CID 167442579) has the molecular formula C12H24Mn2O12 and a molecular weight of 470.19 g/mol. Its IUPAC name is tetrakis(2-hydroxypropanoic acid);manganese.

Molecular Properties

Compound Nametetrakis(2-hydroxypropanoic acid);manganese
PubChem CID167442579
Molecular FormulaC12H24Mn2O12
Molecular Weight470.19 g/mol
Exact Mass470.00
IUPAC Nametetrakis(2-hydroxypropanoic acid);manganese
SMILESCC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)O.[Mn].[Mn]
InChIInChI=1S/4C3H6O3.2Mn/c4*1-2(4)3(5)6;;/h4*2,4H,1H3,(H,5,6);;
InChIKeyIMTHLZVLNWECPT-UHFFFAOYSA-N
XLogP-2.20
TPSA230.12 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.19
LogP ≤ 5-2.20
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of tetrakis(2-hydroxypropanoic acid);manganese?
The IUPAC name of tetrakis(2-hydroxypropanoic acid);manganese (CID 167442579) is tetrakis(2-hydroxypropanoic acid);manganese.
What is the SMILES notation for tetrakis(2-hydroxypropanoic acid);manganese?
The canonical SMILES for tetrakis(2-hydroxypropanoic acid);manganese is CC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)O.CC(O)C(=O)O.[Mn].[Mn].
What is the InChIKey of tetrakis(2-hydroxypropanoic acid);manganese?
The InChIKey is IMTHLZVLNWECPT-UHFFFAOYSA-N. The full InChI is InChI=1S/4C3H6O3.2Mn/c4*1-2(4)3(5)6;;/h4*2,4H,1H3,(H,5,6);;.
What are the key properties of tetrakis(2-hydroxypropanoic acid);manganese?
tetrakis(2-hydroxypropanoic acid);manganese has a molecular weight of 470.19 g/mol, XLogP of -2.20, 4 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(2-hydroxypropanoic acid);manganese is sourced from PubChem (CID 167442579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).