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
    1.8633    2.0013   -0.6169 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0714    0.8165   -0.2105 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3371    0.1478    0.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1255   -1.0973    0.4735 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6669   -1.2969    0.4843 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1031   -2.3698    0.8232 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0289   -0.1020    0.0580 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3938    0.0799   -0.0577 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9440    0.4480   -1.2631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3101    0.6144   -1.3425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1020    0.4110   -0.2195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5426    0.0430    0.9813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1834   -0.1194    1.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0000    0.6469   -0.3477 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.3237    0.6115   -0.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8902   -1.8126    0.7435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2837    0.5945   -2.1075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7582    0.9046   -2.2872 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1626   -0.1142    1.8521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7296   -0.4073    1.9795 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