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4-Chlorobenzanilide

CAT: 0024-sc-489568Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-489568Size:5 g
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CAS Number
6833-15-4

Chemical Information

4-Chlorobenzanilide
CAS Number6833-15-4
PubChem CID346669
IUPAC Name4-chloro-N-phenylbenzamide
Molecular FormulaC13H10ClNO
Molecular Weight231.68
XLogP3.2
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity230
SMILES
C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C13H10ClNO/c14-11-8-6-10(7-9-11)13(16)15-12-4-2-1-3-5-12/h1-9H,(H,15,16)
InChIKey
SFHDVPIEJXCMBP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Chlorobenzanilide
CAS: 6833-15-4
CID: 346669
Formula: C13H10ClNO
MW: 231.68
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight231.68
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass231.0450916
Monoisotopic Mass231.0450916
Topological Polar Surface Area29.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity230
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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