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1600-27-7 molecular structure
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mercury(2+) ion diacetate

ChemBase ID: 128268
Molecular Formular: C4H6HgO4
Molecular Mass: 318.67804
Monoisotopic Mass: 319.99725167
SMILES and InChIs

SMILES:
[Hg+2].[O-]C(=O)C.[O-]C(=O)C
Canonical SMILES:
[O-]C(=O)C.[O-]C(=O)C.[Hg+2]
InChI:
InChI=1S/2C2H4O2.Hg/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2
InChIKey:
BRMYZIKAHFEUFJ-UHFFFAOYSA-L

Cite this record

CBID:128268 http://www.chembase.cn/molecule-128268.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
mercury(2+) ion diacetate
IUPAC Traditional name
mercury(2+) ion diacetate
Synonyms
Mercury(II) acetate, ACS
Acetic acid mercury(II) salt
Mercury(II) acetate
mercuric acetate
mercuriacetate
Mercury(II) acetate
乙酸汞(II), ACS
乙酸汞(II)
CAS Number
1600-27-7
EC Number
216-491-1
MDL Number
MFCD00012165
Beilstein Number
3563831
Merck Index
145873
PubChem SID
162222576
PubChem CID
15337
CHEBI ID
33211
Chemspider ID
14599
Unique Ingredient Identifier
R0G1MCT8Y5
Wikipedia Title
Mercury(II)_acetate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 4.54344  H Acceptors
H Donor LogD (pH = 5.5) -1.2242727 
LogD (pH = 7.4) -2.9968748  Log P -0.22334571 
Molar Refractivity 23.4808 cm3 Polarizability 4.912116 Å3
Polar Surface Area 40.13 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
25 g/100 mL (10 °C)
100 g/100 mL (100 °C) in water
expand Show data source
soluble in alcohol, diethyl ether expand Show data source
Apperance
Crystalline expand Show data source
white-yellow crystals expand Show data source
Melting Point
179 °C (decomposes) expand Show data source
179-182°C expand Show data source
Density
3.28 expand Show data source
3.28 g/cm3, solid expand Show data source
Odor
mild vinegar odor expand Show data source
Storage Warning
Light Sensitive expand Show data source
RTECS
AI8575000 expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Highly toxic Highly toxic (T+) expand Show data source
UN Number
UN1629 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
II expand Show data source
Risk Statements
26/27/28-33-50/53 expand Show data source
Safety Statements
13-28-45-60-61 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS08 expand Show data source
GHS09 expand Show data source
NFPA704
NFPA 704 diagram
0
3
0
expand Show data source
GHS Hazard statements
H300-H310-H330-H373-H400-H410 expand Show data source
GHS Precautionary statements
P280H-P273-P302+P352-P309-P310-P501A expand Show data source
Purity
98.0% min expand Show data source
98+% expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • The solvomercuration of alkenes by Hg(OAc)2, with demercuration by NaBH4, is a useful method for the Markovnikov hydration of alkenes; reviews: Angew. Chem. Int. Ed., 17, 27 (1978); Tetrahedron, 38, 1713 (1982). See, e.g.: Org. Synth. Coll., 6, 766 (1988):
  • • Intramolecular oxy- or amino-mercuration is a useful route to oxygen or nitrogen heterocycles: J. Heterocycl. Chem., 11, 771 (1974); 13, 349 (1976); 15, 1313 (1978):
  • • For an improved method for the synthesis of substituted pyrrolidines using TBTH as reducing agent, avoiding the reaction reversal encountered with borohydride, see: Synth. Commun., 26, 1507 (1996).
  • • Mercuration/demercuration of aliphatic isocyanates provides a mild route to primary amines: Tetrahedron Lett., 36, 8859 (1995).
  • • For a review of organomercurials in synthesis, see: Tetrahedron, 38, 1713 (1982).
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PATENTS

PATENTS

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INTERNET

INTERNET

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