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
   -1.4790    2.3012   -0.1236 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9102    1.1305    0.0313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3101    0.7008    0.0878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3259   -0.5933    0.2591 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9450   -1.1077    0.3278 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6034   -2.3038    0.4866 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0503   -0.0130    0.1828 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3765   -0.0148    0.1807 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0847   -0.2467    1.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4848   -0.2538    1.3530 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1831   -0.0277    0.1922 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4943    0.2086   -0.9901 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1129    0.2095   -0.9681 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0872   -0.0552    0.2697 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.1973    1.3497    0.0007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2149   -1.2064    0.3389 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5387   -0.4251    2.2569 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0205   -0.4338    2.2741 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0684    0.3857   -1.8994 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5849    0.3951   -1.8910 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