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
    1.4211    1.8748   -1.5741 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8386    1.0413   -0.7331 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2499    0.8753   -0.3952 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3110   -0.0928    0.5265 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9619   -0.5877    0.8210 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6530   -1.4942    1.6388 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0374    0.1368    0.0191 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3760   -0.0383    0.0063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0595   -0.0451   -1.1949 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4452   -0.2171   -1.2365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1741   -0.3848   -0.0783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4887   -0.3771    1.1183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1217   -0.2069    1.1495 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0724   -0.6216   -0.0869 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.1165    1.4110   -0.7911 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2149   -0.4404    0.9705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4854    0.0887   -2.1221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9736   -0.2212   -2.1601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0462   -0.5061    2.0320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5615   -0.1946    2.0904 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