2-Ethoxyethyl Trichloroacetate

CAT: 0024-sc-476142Size: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-476142Size:25 g

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CAS Number

30668-97-4

Chemical Information

2-Ethoxyethyl trichloroacetate

CAS Number	30668-97-4
PubChem CID	547792
IUPAC Name	2-ethoxyethyl 2,2,2-trichloroacetate
Molecular Formula	C6H9Cl3O3
Molecular Weight	235.5
XLogP	2.2
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	12
Formal Charge	0
Complexity	143

SMILES

CCOCCOC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C6H9Cl3O3/c1-2-11-3-4-12-5(10)6(7,8)9/h2-4H2,1H3

InChIKey

LEGOWVFXOHMHKG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 30668-97-4

CID: 547792

Formula: C6H9Cl3O3

MW: 235.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	235.5
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	233.961727
Monoisotopic Mass	233.961727
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	143
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-251060	Sodium trichloroacetate
sc-239950	Ethyl trichloroacetate
sc-343337A	2,2,2-trifluoroethyl trichloroacetate
sc-343337	2,2,2-trifluoroethyl trichloroacetate
sc-250385	Methyl trichloroacetate
sc-358739A	2-Ethoxyethyl acrylate
sc-485979	2-Ethoxyethyl Cyanoacetate
sc-230265	2-Ethoxyethyl methacrylate
sc-487685	2-Ethoxyethyl Isobutyrate
sc-482042	Haloxyfop-2-ethoxyethyl

Catalog	Name
RG-E140114-01	Perchlorophenyl 2,2,2-trichloroacetate
RG-T180961-01	Sodium 2,2,2-Trichloroacetate
TRC-E078315-2.5G	Ethyl 2,2,2-Trichloroacetate
RG-I191537-01	Isopropyl 2,2,2-Trichloroacetate
PC1003049-01	2,2,2-Trifluoroethyl 2,2,2-trichloroacetate
AR-E10613-01	2-[ (2,2,2-Trichloroacetyl) oxy]ethyl Trichloroacetate
422309-01	3- ((S) -1-Amino-2- ((1S,3R,5S), -3-cyano-2-aza-biclyclo[3.1.0]hexan-2-yl) -2-oxoethyl) adamantan-1-yl-2,2,2-trichloroacetate
TRC-A585010-250MG	3-((S)-1-Amino-2-((1S,3R,5S),-3-cyano-2-aza-biclyclo[3.1.0]hexan-2-yl)-2-oxoethyl)adamantan-1-yl-2,2,2-trichloroacetate
40000048-1	Sodium Trichloroacetate
OR1002892-01	Methyl Trichloroacetate