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
    1.5236   -0.4347    2.3415 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8979   -0.4009    1.1420 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2590   -0.5926    0.6656 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3062   -0.4966   -0.6376 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9060   -0.2208   -1.1031 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6740   -0.0866   -2.3108 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0412   -0.1642    0.0166 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3668    0.0711    0.0094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0959    0.2556    1.1660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4799    0.4761    1.1347 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1793    0.5197   -0.0433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4697    0.3379   -1.2055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0907    0.1183   -1.1633 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0772    0.8170   -0.0611 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.1063   -0.7899    1.3495 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1923   -0.5995   -1.2348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5943    0.2329    2.1206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0355    0.6205    2.0661 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9766    0.3642   -2.1559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5405   -0.0276   -2.0967 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