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
    1.3561    2.2745   -0.7285 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8808    1.2078   -0.3188 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2820    0.8588   -0.1281 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3330   -0.3766    0.3199 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9733   -0.9167    0.4516 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6642   -2.0757    0.8525 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0578    0.0859    0.0476 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3588   -0.0175    0.0135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0796    0.3928   -1.0968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4661    0.2849   -1.1647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1903   -0.2427   -0.1157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4807   -0.6538    0.9949 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1006   -0.5419    1.0539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1008   -0.3884   -0.2108 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.1101    1.5522   -0.3356 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2365   -0.9018    0.5515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4918    0.7984   -1.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0026    0.6106   -2.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0625   -1.0636    1.8071 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5599   -0.8874    1.9434 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