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
    1.7828   -2.1170   -0.6949 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0026   -0.9334   -0.3253 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3304   -0.3526   -0.1635 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2389    0.9167    0.2372 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8266    1.2165    0.3538 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2812    2.2891    0.7001 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0501    0.0529   -0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3710   -0.0446   -0.0079 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1511    0.6428    0.8965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5365    0.5513    0.8988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1850   -0.2429   -0.0193 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4138   -0.9390   -0.9338 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0212   -0.8404   -0.9277 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0900   -0.4058   -0.0609 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.3141   -0.8101   -0.3224 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0371    1.6027    0.4380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6110    1.2713    1.6172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0988    1.1097    1.6304 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9398   -1.5665   -1.6559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4457   -1.4007   -1.6602 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