dichloromercury;N-ethylthiohydroxylamine

C2H7Cl2HgNS — CID 87226217

IUPACdichloromercury;N-ethylthiohydroxylamine
SMILESCCNS.Cl[Hg]Cl
InChIInChI=1S/C2H7NS.2ClH.Hg/c1-2-3-4;;;/h3-4H,2H2,1H3;2*1H;/q;;;+2/p-2
InChIKeyWYZQTOFTZDPUDF-UHFFFAOYSA-L
MW348.65 g/mol
LogP1.82
Rot. Bonds1

About dichloromercury;N-ethylthiohydroxylamine

dichloromercury;N-ethylthiohydroxylamine (PubChem CID 87226217) has the molecular formula C2H7Cl2HgNS and a molecular weight of 348.65 g/mol. Its IUPAC name is dichloromercury;N-ethylthiohydroxylamine.

Molecular Properties

Compound Namedichloromercury;N-ethylthiohydroxylamine
PubChem CID87226217
Molecular FormulaC2H7Cl2HgNS
Molecular Weight348.65 g/mol
Exact Mass348.94
IUPAC Namedichloromercury;N-ethylthiohydroxylamine
SMILESCCNS.Cl[Hg]Cl
InChIInChI=1S/C2H7NS.2ClH.Hg/c1-2-3-4;;;/h3-4H,2H2,1H3;2*1H;/q;;;+2/p-2
InChIKeyWYZQTOFTZDPUDF-UHFFFAOYSA-L
XLogP1.82
TPSA12.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.65
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dichloromercury;N-ethylthiohydroxylamine?
The IUPAC name of dichloromercury;N-ethylthiohydroxylamine (CID 87226217) is dichloromercury;N-ethylthiohydroxylamine.
What is the SMILES notation for dichloromercury;N-ethylthiohydroxylamine?
The canonical SMILES for dichloromercury;N-ethylthiohydroxylamine is CCNS.Cl[Hg]Cl.
What is the InChIKey of dichloromercury;N-ethylthiohydroxylamine?
The InChIKey is WYZQTOFTZDPUDF-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H7NS.2ClH.Hg/c1-2-3-4;;;/h3-4H,2H2,1H3;2*1H;/q;;;+2/p-2.
What are the key properties of dichloromercury;N-ethylthiohydroxylamine?
dichloromercury;N-ethylthiohydroxylamine has a molecular weight of 348.65 g/mol, XLogP of 1.82, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromercury;N-ethylthiohydroxylamine is sourced from PubChem (CID 87226217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).