acetyloxymercury;mercury(1+);nitrate

C2H3Hg2NO5 — CID 142629064

IUPACacetyloxymercury;mercury(1+);nitrate
SMILESCC(=O)O[Hg].O=[N+]([O-])[O-].[Hg+]
InChIInChI=1S/C2H4O2.2Hg.NO3/c1-2(3)4;;;2-1(3)4/h1H3,(H,3,4);;;/q;2*+1;-1/p-1
InChIKeyCQODRSCLWYZORN-UHFFFAOYSA-M
MW522.23 g/mol
LogP-0.23
Rot. Bonds

About acetyloxymercury;mercury(1+);nitrate

acetyloxymercury;mercury(1+);nitrate (PubChem CID 142629064) has the molecular formula C2H3Hg2NO5 and a molecular weight of 522.23 g/mol. Its IUPAC name is acetyloxymercury;mercury(1+);nitrate.

Molecular Properties

Compound Nameacetyloxymercury;mercury(1+);nitrate
PubChem CID142629064
Molecular FormulaC2H3Hg2NO5
Molecular Weight522.23 g/mol
Exact Mass524.94
IUPAC Nameacetyloxymercury;mercury(1+);nitrate
SMILESCC(=O)O[Hg].O=[N+]([O-])[O-].[Hg+]
InChIInChI=1S/C2H4O2.2Hg.NO3/c1-2(3)4;;;2-1(3)4/h1H3,(H,3,4);;;/q;2*+1;-1/p-1
InChIKeyCQODRSCLWYZORN-UHFFFAOYSA-M
XLogP-0.23
TPSA92.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500522.23
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of acetyloxymercury;mercury(1+);nitrate?
The IUPAC name of acetyloxymercury;mercury(1+);nitrate (CID 142629064) is acetyloxymercury;mercury(1+);nitrate.
What is the SMILES notation for acetyloxymercury;mercury(1+);nitrate?
The canonical SMILES for acetyloxymercury;mercury(1+);nitrate is CC(=O)O[Hg].O=[N+]([O-])[O-].[Hg+].
What is the InChIKey of acetyloxymercury;mercury(1+);nitrate?
The InChIKey is CQODRSCLWYZORN-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H4O2.2Hg.NO3/c1-2(3)4;;;2-1(3)4/h1H3,(H,3,4);;;/q;2*+1;-1/p-1.
What are the key properties of acetyloxymercury;mercury(1+);nitrate?
acetyloxymercury;mercury(1+);nitrate has a molecular weight of 522.23 g/mol, XLogP of -0.23, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for acetyloxymercury;mercury(1+);nitrate is sourced from PubChem (CID 142629064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).