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
   -1.6114   -2.3326    0.0688 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9259   -1.1378   -0.0023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3073   -0.6750   -0.1229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3250    0.6395   -0.1762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9303    1.1119   -0.0927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5519    2.3269   -0.1150 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0524   -0.0010    0.0166 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3768    0.0098    0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0745   -1.0834    0.6086 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4606   -1.0981    0.7353 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1918    0.0086    0.3756 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5254    1.1079   -0.1031 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1305    1.1074   -0.2235 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0855   -0.0387    0.5663 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.2389   -1.2590   -0.1647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1792    1.3166   -0.2670 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5211   -1.9492    0.8900 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9657   -1.9994    1.1247 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1235    1.9635   -0.3806 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6671    1.9820   -0.6024 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