manganese(3+);tris(propan-2-olate)

C9H21MnO3 — CID 91971223

IUPACmanganese(3+);tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].[Mn+3]
InChIInChI=1S/3C3H7O.Mn/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
InChIKeyXUGKYPGWLBESBF-UHFFFAOYSA-N
MW232.20 g/mol
LogP-0.74
Rot. Bonds

About manganese(3+);tris(propan-2-olate)

manganese(3+);tris(propan-2-olate) (PubChem CID 91971223) has the molecular formula C9H21MnO3 and a molecular weight of 232.20 g/mol. Its IUPAC name is manganese(3+);tris(propan-2-olate).

Molecular Properties

Compound Namemanganese(3+);tris(propan-2-olate)
PubChem CID91971223
Molecular FormulaC9H21MnO3
Molecular Weight232.20 g/mol
Exact Mass232.09
IUPAC Namemanganese(3+);tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].[Mn+3]
InChIInChI=1S/3C3H7O.Mn/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
InChIKeyXUGKYPGWLBESBF-UHFFFAOYSA-N
XLogP-0.74
TPSA69.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 5-0.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of manganese(3+);tris(propan-2-olate)?
The IUPAC name of manganese(3+);tris(propan-2-olate) (CID 91971223) is manganese(3+);tris(propan-2-olate).
What is the SMILES notation for manganese(3+);tris(propan-2-olate)?
The canonical SMILES for manganese(3+);tris(propan-2-olate) is CC(C)[O-].CC(C)[O-].CC(C)[O-].[Mn+3].
What is the InChIKey of manganese(3+);tris(propan-2-olate)?
The InChIKey is XUGKYPGWLBESBF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C3H7O.Mn/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3.
What are the key properties of manganese(3+);tris(propan-2-olate)?
manganese(3+);tris(propan-2-olate) has a molecular weight of 232.20 g/mol, XLogP of -0.74, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for manganese(3+);tris(propan-2-olate) is sourced from PubChem (CID 91971223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).