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
    1.7580   -1.8780   -1.2336 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0423   -0.8564   -0.5546 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3441   -0.3238   -0.1854 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2304    0.7692    0.5363 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8068    1.0183    0.6829 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2872    1.9952    1.3228 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0651    0.0017    0.0007 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3538   -0.0506   -0.0529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0806    0.3984   -1.1381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4599    0.3434   -1.1849 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1833   -0.1718   -0.1300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4673   -0.6227    0.9580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0858   -0.5671    1.0037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0917   -0.2466   -0.1957 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.3081   -0.7495   -0.4548 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9969    1.4027    0.9653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5193    0.8054   -1.9740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0175    0.6991   -2.0445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0388   -1.0345    1.7991 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5410   -0.9324    1.8796 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