2-ethoxyethylmercury(1+) chloride

C4H9ClHgO — CID 164512140

IUPAC2-ethoxyethylmercury(1+) chloride
SMILESCCOCC[Hg+].[Cl-]
InChIInChI=1S/C4H9O.ClH.Hg/c1-3-5-4-2;;/h1,3-4H2,2H3;1H;/q;;+1/p-1
InChIKeySKJHMLZNOHLSOK-UHFFFAOYSA-M
MW309.16 g/mol
LogP-2.01
Rot. Bonds3

About 2-ethoxyethylmercury(1+) chloride

2-ethoxyethylmercury(1+) chloride (PubChem CID 164512140) has the molecular formula C4H9ClHgO and a molecular weight of 309.16 g/mol. Its IUPAC name is 2-ethoxyethylmercury(1+) chloride.

Molecular Properties

Compound Name2-ethoxyethylmercury(1+) chloride
PubChem CID164512140
Molecular FormulaC4H9ClHgO
Molecular Weight309.16 g/mol
Exact Mass310.00
IUPAC Name2-ethoxyethylmercury(1+) chloride
SMILESCCOCC[Hg+].[Cl-]
InChIInChI=1S/C4H9O.ClH.Hg/c1-3-5-4-2;;/h1,3-4H2,2H3;1H;/q;;+1/p-1
InChIKeySKJHMLZNOHLSOK-UHFFFAOYSA-M
XLogP-2.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.16
LogP ≤ 5-2.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Diethyl Ether
CID 3283
2-Ethoxyethylmercury chloride
CID 67167
2,2'-Oxybis((2H5)ethane)
CID 2723765
Triethyloxonium
CID 165095
CID 12660730
CID 12660730
CID 21058325
CID 21058325
Ether hydrochloride
CID 10953452
Deuteroathylather
CID 11332414
CID 12660729
CID 12660729
Diethyl(methyl)oxidanium
CID 14569188
Diethyl ester dihydrochloride
CID 19848039
Ether trihydrochloride
CID 21844783

Frequently Asked Questions

What is the IUPAC name of 2-ethoxyethylmercury(1+) chloride?
The IUPAC name of 2-ethoxyethylmercury(1+) chloride (CID 164512140) is 2-ethoxyethylmercury(1+) chloride.
What is the SMILES notation for 2-ethoxyethylmercury(1+) chloride?
The canonical SMILES for 2-ethoxyethylmercury(1+) chloride is CCOCC[Hg+].[Cl-].
What is the InChIKey of 2-ethoxyethylmercury(1+) chloride?
The InChIKey is SKJHMLZNOHLSOK-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9O.ClH.Hg/c1-3-5-4-2;;/h1,3-4H2,2H3;1H;/q;;+1/p-1.
What are the key properties of 2-ethoxyethylmercury(1+) chloride?
2-ethoxyethylmercury(1+) chloride has a molecular weight of 309.16 g/mol, XLogP of -2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxyethylmercury(1+) chloride is sourced from PubChem (CID 164512140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).