mercury(1+);methanolate

CH3HgO — CID 87666391

IUPACmercury(1+);methanolate
SMILESC[O-].[Hg+]
InChIInChI=1S/CH3O.Hg/c1-2;/h1H3;/q-1;+1
InChIKeyNRMXZJVDGLYURI-UHFFFAOYSA-N
MW231.62 g/mol
LogP-1.03
Rot. Bonds

About mercury(1+);methanolate

mercury(1+);methanolate (PubChem CID 87666391) has the molecular formula CH3HgO and a molecular weight of 231.62 g/mol. Its IUPAC name is mercury(1+);methanolate.

Molecular Properties

Compound Namemercury(1+);methanolate
PubChem CID87666391
Molecular FormulaCH3HgO
Molecular Weight231.62 g/mol
Exact Mass232.99
IUPAC Namemercury(1+);methanolate
SMILESC[O-].[Hg+]
InChIInChI=1S/CH3O.Hg/c1-2;/h1H3;/q-1;+1
InChIKeyNRMXZJVDGLYURI-UHFFFAOYSA-N
XLogP-1.03
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.62
LogP ≤ 5-1.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of mercury(1+);methanolate?
The IUPAC name of mercury(1+);methanolate (CID 87666391) is mercury(1+);methanolate.
What is the SMILES notation for mercury(1+);methanolate?
The canonical SMILES for mercury(1+);methanolate is C[O-].[Hg+].
What is the InChIKey of mercury(1+);methanolate?
The InChIKey is NRMXZJVDGLYURI-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3O.Hg/c1-2;/h1H3;/q-1;+1.
What are the key properties of mercury(1+);methanolate?
mercury(1+);methanolate has a molecular weight of 231.62 g/mol, XLogP of -1.03, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for mercury(1+);methanolate is sourced from PubChem (CID 87666391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).