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Molecule
Ethylmercury Chloride
CAS: 107-27-7 · C2H5ClHg
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 107-27-7
- Molecular Formula
- C2H5ClHg
- Molecular Mass
- 265.11 g/mol
Identifiers
CAS Registry Number
107-27-7
SMILES
[CH2]C.[Cl-].[Hg+]
InChI Key
QWUGXIXRFGEYBD-UHFFFAOYSA-M
InChI
InChI=1S/C2H5.ClH.Hg/c1-2;;/h1H2,2H3;1H;/q;;+1/p-1
Names and Synonyms
- Ethylmercury Chloride Common Name
- Mercury, chloroethyl- Synonym
- Ethylmercury chloride Synonym
- Ceresan Synonym
- Chloroethylmercury Synonym
- Ethylmercuric chloride Synonym
- Granosan Synonym
- Cryptodine Synonym
- Emcon D Synonym
- Cryptodin Synonym
- Criptodin Synonym
- Monoethylmercury chloride Synonym
- Ceresan (fungicide) Synonym
- NSC 1203 Synonym
- NSC 60515 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 265.11 g/mol | CAS Common Chemistry |
| 265.97862084 g/mol | RDKit | |
| 265.105 g/mol | RDKit | |
| 267.12 g/mol | chempirical lib | |
| Canonical SMILES | Cl[Hg]CC | CAS Common Chemistry |
| InChI | InChI=1S/C2H5.ClH.Hg/c1-2;;/h1H2,2H3;1H;/q;;+1/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=QWUGXIXRFGEYBD-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | 192 °C | CAS Common Chemistry |
| Name | Ethylmercury chloride | CAS Common Chemistry |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -2.158109999999999 | RDKit |
| -2.1581 | RDKit | |
| Molar Refractivity | 11.031000000000002 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.5 | RDKit |
| Exact Mass | 265.105 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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5
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 265.11 g/mol. Edit any field — others recompute live.
