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
   -1.1654   -1.0427   -2.2382 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7508   -0.5790   -1.2227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1643   -0.4583   -0.9389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3681    0.0878    0.2483 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0470    0.3715    0.8421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8296    0.8942    1.9714 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0507   -0.0469   -0.0806 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3727    0.0231    0.0528 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1222    0.6754   -0.9253 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4883    0.7304   -0.7655 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1440    0.1693    0.3169 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3965   -0.4768    1.2841 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0260   -0.5361    1.1318 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0604    0.2893    0.4806 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.9324   -0.7875   -1.6429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3088    0.3052    0.7373 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6170    1.1268   -1.7876 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1181    1.2280   -1.4987 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8672   -0.9318    2.1547 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4046   -1.0420    1.8805 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