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Home Halogens Ethyl dichloroacetate

Ethyl dichloroacetate

CAS No.:
535-15-9
Catalog Number:
AG003QES
Molecular Formula:
C4H6Cl2O2
Molecular Weight:
156.9952
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
98%
In Stock USA
United States
$50
- +
100g
98%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG003QES
Chemical Name:
Ethyl dichloroacetate
CAS Number:
535-15-9
Molecular Formula:
C4H6Cl2O2
Molecular Weight:
156.9952
MDL Number:
MFCD00018858
IUPAC Name:
ethyl 2,2-dichloroacetate
InChI:
InChI=1S/C4H6Cl2O2/c1-2-8-4(7)3(5)6/h3H,2H2,1H3
InChI Key:
IWYBVQLPTCMVFO-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(Cl)Cl
EC Number:
208-611-6
Properties
Complexity:
82.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.974g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.99g/mol
Monoisotopic Mass:
155.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Atom-transfer radical addition reactions catalyzed by RuCp* complexes: a mechanistic study. Chemistry (Weinheim an der Bergstrasse, Germany) 20091102
Ring expansion reactions of 4-amino-1,1-dioxo-[1,2,3,5]-thiatriazoles. Organic & biomolecular chemistry 20070207
Properties