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
   -1.1064    2.4135    0.3570 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6854    1.3083    0.2635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1212    1.0676    0.3918 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3448   -0.2268    0.2306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0740   -0.9061   -0.0114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9250   -2.1322   -0.2055 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0327    0.0620    0.0100 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3658   -0.0887   -0.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2252    0.4087    0.7701 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6114    0.2949    0.6566 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0925   -0.3543   -0.4664 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2573   -0.8711   -1.4383 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8794   -0.7294   -1.2749 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9820   -0.5401   -0.6740 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.8252    1.8640    0.5862 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3458   -0.6400    0.2844 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8622    0.9077    1.6340 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2911    0.6875    1.3987 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6473   -1.3809   -2.3194 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2463   -1.1447   -2.0530 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