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2-Bromo-acetamide-2’,5-dichlorobenzophenone

CAT: 0572-TRC-B678960-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-B678960-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5504-92-7
Synonyms
2-Bromo-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]acetamide; 2-Bromo-4'-chloro-2'-(o-chlorobenzoyl)acetanilide;
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
O=C(C1=C(NC(CBr)=O)C=CC(Cl)=C1)C2=CC=CC=C2Cl
Molecular Formula
C15H10BrCl2NO2
Molecular Weight
387.06
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2-bromo-N-(4-chloro-2-(2-chlorobenzoyl)phenyl)acetamide
CAS Number5504-92-7
PubChem CID79640
IUPAC Name2-bromo-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]acetamide
Molecular FormulaC15H10BrCl2NO2
Molecular Weight387.1
XLogP5
Topological Polar Surface Area46.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count21
Formal Charge0
Complexity394
SMILES
C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)NC(=O)CBr)Cl
InChI
InChI=1S/C15H10BrCl2NO2/c16-8-14(20)19-13-6-5-9(17)7-11(13)15(21)10-3-1-2-4-12(10)18/h1-7H,8H2,(H,19,20)
InChIKey
JQMAWYRGSOSWNJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-bromo-N-(4-chloro-2-(2-chlorobenzoyl)phenyl)acetamide
CAS: 5504-92-7
CID: 79640
Formula: C15H10BrCl2NO2
MW: 387.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight387.1
XLogP35
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass384.92720
Monoisotopic Mass384.92720
Topological Polar Surface Area46.2 Ų
Heavy Atom Count21
Formal Charge0
Complexity394
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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CatalogName
263153-012-Bromo-acetamide-2',5-dichlorobenzophenone
CS-T-078572-Bromo-acetamide-2,5-dichlorobenzophenone
0045862-Bromo-acetamide-2’,5-dichlorobenzophenone
sc-3960132-Bromo-acetamide-2′,5-dichlorobenzophenone
274316-012,5-Dichlorobenzophenone
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0021342-Amino-2’,5-dichlorobenzophenone
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