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
   -1.7006    1.6870   -1.6465 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9276    0.8474   -0.7374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3062    0.5580   -0.2955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2723   -0.3550    0.6637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8742   -0.7152    0.9058 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4024   -1.5460    1.7364 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0509    0.0547    0.0121 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3636   -0.0002   -0.0528 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0321   -1.1145   -0.5161 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4164   -1.1728   -0.5633 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1813   -0.1091   -0.1446 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5239    1.0049    0.3171 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1449    1.0672    0.3660 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1066   -0.1538   -0.1954 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.2177    1.0022   -0.6682 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0967   -0.8117    1.2293 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4201   -1.9633   -0.8507 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8890   -2.0620   -0.9321 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1472    1.8358    0.6428 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6234    1.9464    0.7293 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