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624-70-4 molecular structure
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1-chloro-2-iodoethane

ChemBase ID: 302205
Molecular Formular: C2H4ClI
Molecular Mass: 190.41063
Monoisotopic Mass: 189.90462581
SMILES and InChIs

SMILES:
C(CI)Cl
Canonical SMILES:
ClCCI
InChI:
InChI=1S/C2H4ClI/c3-1-2-4/h1-2H2
InChIKey:
JTWWWQGSFTWWDL-UHFFFAOYSA-N

Cite this record

CBID:302205 http://www.chembase.cn/molecule-302205.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-chloro-2-iodoethane
IUPAC Traditional name
1-chloro-2-iodoethane
Synonyms
Ethylene chloroiodide
1-Chloro-2-iodoethane
1-氯-2-碘乙烷
CAS Number
624-70-4
EC Number
000-000-0
MDL Number
MFCD00041453
Beilstein Number
1730865

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.9603702  LogD (pH = 7.4) 1.9603702 
Log P 1.9603702  Molar Refractivity 29.0418 cm3
Polarizability 11.606643 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
61-62°C/30mm expand Show data source
Density
2.088 expand Show data source
Refractive Index
1.5660 expand Show data source
Storage Warning
Light Sensitive expand Show data source
European Hazard Symbols
X expand Show data source
Risk Statements
22 expand Show data source
Safety Statements
36 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS Hazard statements
H301 expand Show data source
GHS Precautionary statements
P264-P270-P301+P310-P321-P405-P501A expand Show data source
Purity
96% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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  • • Mild electrophile for iodination of metallated species, as in the conversion of an ortho-lithiated benzyl ether to the corresponding ortho-iodide: J. Chem. Soc., Chem. Commun., 124 (1979); J. Org. Chem., 47, 2541 (1982); J. Chem. Soc., Perkin 1, 115 (1985). See also 1,2-Diiodoethane, L03019.
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PATENTS

PATENTS

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INTERNET

INTERNET

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