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
    1.4744    1.3040    1.9471 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8903    0.5327    1.0338 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2885    0.1320    0.7900 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3011   -0.6783   -0.2523 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9358   -0.8492   -0.7389 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5373   -1.5456   -1.7145 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0471   -0.0868    0.0708 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3613    0.0342   -0.0478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9928    0.5313   -1.1708 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3519    0.6493   -1.2884 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1592    0.2600   -0.2482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5793   -0.2446    0.8994 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2059   -0.3507    0.9864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0571    0.4216   -0.4044 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.1481    0.4622    1.3833 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1633   -1.1475   -0.6891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3424    0.8376   -1.9910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8353    1.0466   -2.1887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1842   -0.5613    1.7391 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7164   -0.7473    1.8842 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