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N1- (2,3-Dichlorophenyl) -2-chloroacetamide

CAT: 0127-OR27025-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR27025-01Size:1 g
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CAS Number
33560-47-3
MDL Number
MFCD00028173
Purity
=95%
Smiles
ClCC(=O)Nc1cccc(Cl)c1Cl

Chemical Information

2-chloro-N-(2,3-dichlorophenyl)acetamide
CAS Number33560-47-3
PubChem CID736953
IUPAC Name2-chloro-N-(2,3-dichlorophenyl)acetamide
Molecular FormulaC8H6Cl3NO
Molecular Weight238.5
XLogP2.7
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity188
SMILES
C1=CC(=C(C(=C1)Cl)Cl)NC(=O)CCl
InChI
InChI=1S/C8H6Cl3NO/c9-4-7(13)12-6-3-1-2-5(10)8(6)11/h1-3H,4H2,(H,12,13)
InChIKey
NBGQBIFGVDDWKO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-chloro-N-(2,3-dichlorophenyl)acetamide
CAS: 33560-47-3
CID: 736953
Formula: C8H6Cl3NO
MW: 238.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight238.5
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass236.951497
Monoisotopic Mass236.951497
Topological Polar Surface Area29.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity188
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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