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
    1.4593    0.4661    2.3361 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8909    0.1493    1.1963 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2869   -0.0436    0.7563 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2959   -0.3722   -0.5264 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9171   -0.4181   -1.0153 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5665   -0.7006   -2.2000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0401   -0.0863    0.0846 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3814   -0.0212   -0.0044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0358    1.0944    0.4731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4158    1.2374    0.4095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1488    0.2312   -0.1488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5331   -0.8858   -0.6299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1607   -1.0130   -0.5595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0374    0.3989   -0.2574 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.1215    0.0819    1.4349 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2153   -0.5633   -1.0617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4803    1.9052    0.9205 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8726    2.1364    0.8038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0927   -1.7054   -1.0792 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6351   -1.8913   -0.9329 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