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2- (2,6-Dichlorophenoxy) acetyl chloride

CAT: 0127-OR1055461-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1055461-01Size:250 mg
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CAS Number
20143-46-8
MDL Number
MFCD03421609
Purity
97%
Smiles
O=C(Cl)COC1=C(Cl)C=CC=C1Cl

Chemical Information

(2,6-Dichlorophenoxy)acetyl chloride
CAS Number20143-46-8
PubChem CID13789694
IUPAC Name2-(2,6-dichlorophenoxy)acetyl chloride
Molecular FormulaC8H5Cl3O2
Molecular Weight239.5
XLogP3.7
Topological Polar Surface Area26.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity176
SMILES
C1=CC(=C(C(=C1)Cl)OCC(=O)Cl)Cl
InChI
InChI=1S/C8H5Cl3O2/c9-5-2-1-3-6(10)8(5)13-4-7(11)12/h1-3H,4H2
InChIKey
RPNBBIYJWHBRED-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (2,6-Dichlorophenoxy)acetyl chloride
CAS: 20143-46-8
CID: 13789694
Formula: C8H5Cl3O2
MW: 239.5
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight239.5
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass237.935512
Monoisotopic Mass237.935512
Topological Polar Surface Area26.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity176
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-335538(2,5-dichlorophenoxy) acetyl chloride
AAA77474(2,4-Dichlorophenoxy) acetyl chloride
sc-335331(2,3-dichlorophenoxy) acetyl chloride
sc-322094(2,6-Dichlorophenyl) acetyl chloride
sc-322097(2,6-Difluoro-phenyl) -acetyl chloride
289826-01Thiophene-2-acetyl chloride
AR-A02611-012-Thiophene Acetyl Chloride
FN121016-01(2-Naphthyloxy) acetyl chloride
sc-288267(2-nitrophenoxy) acetyl chloride
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