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
    1.5054    2.2153   -0.2647 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8934    1.0152   -0.2168 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2625    0.5371   -0.2923 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2627   -0.7887   -0.2064 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8970   -1.2749   -0.0685 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5463   -2.4725    0.0376 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0506   -0.1385   -0.0762 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3618   -0.0334    0.0276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9588    0.8876    0.8954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3375    0.9885    0.9942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1673    0.1858    0.2413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5717   -0.7176   -0.6101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1849   -0.8396   -0.7287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0781    0.3256    0.3818 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.1201    1.2018   -0.4006 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1654   -1.3811   -0.2380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3181    1.5147    1.4839 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8065    1.6971    1.6637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1792   -1.3489   -1.2031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7395   -1.5735   -1.4201 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