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
    1.3860    2.3769   -0.0509 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8162    1.2283    0.1245 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1993    0.8478    0.3335 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2833   -0.4599    0.4839 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9656   -1.0590    0.3878 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6275   -2.2598    0.4753 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0556    0.0376    0.1596 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3601   -0.0400   -0.0067 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9213    0.3006   -1.2263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2842    0.2402   -1.4304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1573   -0.1618   -0.4323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5875   -0.4980    0.7766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2191   -0.4404    0.9913 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0466   -0.2434   -0.7248 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.0497    1.5477    0.3618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1816   -1.0171    0.6525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2371    0.6170   -2.0104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7040    0.5069   -2.3820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2682   -0.8164    1.5704 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7795   -0.7073    1.9467 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