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N- (4-Aminophenyl) malemide

CAT: 0127-OR54116-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR54116-01Size:250 mg
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CAS Number
29753-26-2
Synonyms
1- (4-aminophenyl) -1H-pyrrole-2,5-dione
MDL Number
MFCD00051191
Purity
=95%
Smiles
Nc1ccc(cc1)N2C(=O)C=CC2=O

Chemical Information

N-(4-Aminophenyl)maleimide
CAS Number29753-26-2
PubChem CID122469
IUPAC Name1-(4-aminophenyl)pyrrole-2,5-dione
Molecular FormulaC10H8N2O2
Molecular Weight188.18
XLogP0.4
Topological Polar Surface Area63.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity272
SMILES
C1=CC(=CC=C1N)N2C(=O)C=CC2=O
InChI
InChI=1S/C10H8N2O2/c11-7-1-3-8(4-2-7)12-9(13)5-6-10(12)14/h1-6H,11H2
InChIKey
XOPCHXSYQHXLHJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-Aminophenyl)maleimide
CAS: 29753-26-2
CID: 122469
Formula: C10H8N2O2
MW: 188.18
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight188.18
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass188.058577502
Monoisotopic Mass188.058577502
Topological Polar Surface Area63.4 Ų
Heavy Atom Count14
Formal Charge0
Complexity272
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