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Deferasirox Diacyl Impurity

CAT: 1299-RM-D061804-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-D061804-01Size:10 mg
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CAS Number
1972-71-0
Synonyms
2-Hydroxy-N- (2-hydroxy-benzoyl) -benzamide
Molecular Formula
C14H11NO4
Molecular Weight
257.24
Target Alternative Name
Deferasirox
Product Name Synonym
2-Hydroxy-N- (2-hydroxy-benzoyl) -benzamide

Chemical Information

Disalicylamide
CAS Number1972-71-0
PubChem CID2047843
IUPAC Name2-hydroxy-N-(2-hydroxybenzoyl)benzamide
Molecular FormulaC14H11NO4
Molecular Weight257.24
XLogP3
Topological Polar Surface Area86.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity312
SMILES
C1=CC=C(C(=C1)C(=O)NC(=O)C2=CC=CC=C2O)O
InChI
InChI=1S/C14H11NO4/c16-11-7-3-1-5-9(11)13(18)15-14(19)10-6-2-4-8-12(10)17/h1-8,16-17H,(H,15,18,19)
InChIKey
QBPYSJJNOYHIPX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Disalicylamide
CAS: 1972-71-0
CID: 2047843
Formula: C14H11NO4
MW: 257.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight257.24
XLogP33
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass257.06880783
Monoisotopic Mass257.06880783
Topological Polar Surface Area86.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity312
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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