manganese;methanone

C5H5MnO5-5 — CID 57468561

IUPACmanganese;methanone
SMILES[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[Mn]
InChIInChI=1S/5CHO.Mn/c5*1-2;/h5*1H;/q5*-1;
InChIKeyVHUXTPRJJJGGFX-UHFFFAOYSA-N
MW200.03 g/mol
LogP-1.37
Rot. Bonds

About manganese;methanone

manganese;methanone (PubChem CID 57468561) has the molecular formula C5H5MnO5-5 and a molecular weight of 200.03 g/mol. Its IUPAC name is manganese;methanone.

Molecular Properties

Compound Namemanganese;methanone
PubChem CID57468561
Molecular FormulaC5H5MnO5-5
Molecular Weight200.03 g/mol
Exact Mass199.95
IUPAC Namemanganese;methanone
SMILES[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[Mn]
InChIInChI=1S/5CHO.Mn/c5*1-2;/h5*1H;/q5*-1;
InChIKeyVHUXTPRJJJGGFX-UHFFFAOYSA-N
XLogP-1.37
TPSA85.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.03
LogP ≤ 5-1.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of manganese;methanone?
The IUPAC name of manganese;methanone (CID 57468561) is manganese;methanone.
What is the SMILES notation for manganese;methanone?
The canonical SMILES for manganese;methanone is [CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[CH-]=O.[Mn].
What is the InChIKey of manganese;methanone?
The InChIKey is VHUXTPRJJJGGFX-UHFFFAOYSA-N. The full InChI is InChI=1S/5CHO.Mn/c5*1-2;/h5*1H;/q5*-1;.
What are the key properties of manganese;methanone?
manganese;methanone has a molecular weight of 200.03 g/mol, XLogP of -1.37, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for manganese;methanone is sourced from PubChem (CID 57468561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).