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
   -1.6627    2.3321   -0.0676 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9345    1.1146   -0.1905 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2892    0.5936   -0.3519 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2601   -0.7183   -0.4577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8606   -1.1506   -0.3703 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5562   -2.3831   -0.4446 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0566   -0.0037   -0.2049 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3591    0.0238   -0.0691 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0517    1.1838    0.2110 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4444    1.2135    0.3523 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1768    0.0646    0.2124 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5126   -1.1056   -0.0672 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1185   -1.1143   -0.2043 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0730   -0.0215    0.3882 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.2000    1.2010   -0.3797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1379   -1.3463   -0.5857 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5603    2.1230    0.3370 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9799    2.1195    0.5705 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0228   -2.0452   -0.1916 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6588   -2.0810   -0.4246 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