Monomers

N-(4-Bromophenyl)maleimide

Identifiers

IUPAC name
1-(4-bromophenyl)pyrrole-2,5-dione
InchI
InChI=1S/C10H6BrNO2/c11-7-1-3-8(4-2-7)12-9(13)5-6-10(12)14/h1-6H
InchI Key
FECSFBYOMHWJQG-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1c1ccc(cc1)Br
Canonical SMILES
C1=CC(=CC=C1N2C(=O)C=CC2=O)Br
Isomeric SMILES
C1=CC(=CC=C1N2C(=O)C=CC2=O)Br
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H6BrNO2
Heavy Atom Count
14
Molecular Weight
252.067
Exact Molecular Weight
250.9582
Valence Electrons
70
Radical Electrons
0
tPSA
37.38
MolLogP
1.8785
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1

MOL File


     RDKit          3D

 20 21  0  0  0  0  0  0  0  0999 V2000
    1.7342   -2.1547   -0.5201 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9805   -0.9280   -0.3893 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3201   -0.3638   -0.4985 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2241    0.9431   -0.3097 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8102    1.2947   -0.0670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4026    2.4631    0.1464 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0350    0.1009   -0.1202 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3785   -0.0168    0.0597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0673   -1.0345   -0.5629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4374   -1.1630   -0.3997 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1678   -0.2935    0.3810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4794    0.7245    1.0037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1018    0.8559    0.8414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0613   -0.4804    0.5987 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.2529   -0.9026   -0.7000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0827    1.5988   -0.3400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280   -1.7397   -1.1856 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9857   -1.9595   -0.8848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0620    1.4013    1.6138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5732    1.6540    1.3332 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 11 14  1  0
  7  2  1  0
 13  8  1  0
  3 15  1  0
  4 16  1  0
  9 17  1  0
 10 18  1  0
 12 19  1  0
 13 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers