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Bismaleimide

CAT: 0127-OR1029950-02Size: 500 gDry Ice: NoHazardous: No
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CAT#:0127-OR1029950-02Size:500 g
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CAS Number
13676-54-5
Synonyms
1-[4-[[4- (2,5-dioxopyrrol-1-yl) phenyl]methyl]phenyl]pyrrole-2,5-dione
Purity
98%
Smiles
C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C=CC3=O)N4C(=O)C=CC4=O

Chemical Information

1,1'-(Methylenedi-p-phenylene)bismaleimide
CAS Number13676-54-5
PubChem CID83648
IUPAC Name1-[4-[[4-(2,5-dioxopyrrol-1-yl)phenyl]methyl]phenyl]pyrrole-2,5-dione
Molecular FormulaC21H14N2O4
Molecular Weight358.3
XLogP2.1
Topological Polar Surface Area74.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity614
SMILES
C1=CC(=CC=C1CC2=CC=C(C=C2)N3C(=O)C=CC3=O)N4C(=O)C=CC4=O
InChI
InChI=1S/C21H14N2O4/c24-18-9-10-19(25)22(18)16-5-1-14(2-6-16)13-15-3-7-17(8-4-15)23-20(26)11-12-21(23)27/h1-12H,13H2
InChIKey
XQUPVDVFXZDTLT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,1'-(Methylenedi-p-phenylene)bismaleimide
CAS: 13676-54-5
CID: 83648
Formula: C21H14N2O4
MW: 358.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight358.3
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass358.09535693
Monoisotopic Mass358.09535693
Topological Polar Surface Area74.8 Ų
Heavy Atom Count27
Formal Charge0
Complexity614
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