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Home Halogens Methyl Trichloroacetate

Methyl Trichloroacetate

CAS No.:
598-99-2
Catalog Number:
AG003S2X
Molecular Formula:
C3H3Cl3O2
Molecular Weight:
177.4137
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
In Stock USA
United States
$154
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Product Description
Catalog Number:
AG003S2X
Chemical Name:
Methyl Trichloroacetate
CAS Number:
598-99-2
Molecular Formula:
C3H3Cl3O2
Molecular Weight:
177.4137
MDL Number:
MFCD00000794
IUPAC Name:
methyl 2,2,2-trichloroacetate
InChI:
InChI=1S/C3H3Cl3O2/c1-8-2(7)3(4,5)6/h1H3
InChI Key:
VHFUHRXYRYWELT-UHFFFAOYSA-N
SMILES:
COC(=O)C(Cl)(Cl)Cl
EC Number:
209-960-7
NSC Number:
38452
UN Number:
2533
Properties
Complexity:
95.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.92g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.405g/mol
Monoisotopic Mass:
175.92g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Synthesis and anticonvulsant activity of O-alkylated derivatives of 1-(2-naphthyl)-2-(imidazol-1-yl)ethanone oxime. Arzneimittel-Forschung 20120901
Quantitation and identity confirmation of residues of quinolones in tilapia fillets by LC-ESI-MS-MS QToF. Analytical and bioanalytical chemistry 20090801
Methyl chloroacetate as an extraction solvent for coupling liquid-liquid semimicroextraction with micellar electrokinetic chromatography through on-capillary decomposition for the separation of neutral compounds with concentration enhancement. Journal of chromatography. A 20070413
Quantitative analysis of phytoestrogens in kudzu-root, soy and spiked serum samples by high-pressure liquid chromatography. Biomedical chromatography : BMC 20040701
Properties