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
   -1.7486    2.2284   -0.2610 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9831    1.0090   -0.0984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3415    0.4863   -0.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2660   -0.8209    0.1464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8554   -1.2139    0.1989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5066   -2.4119    0.3597 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0447   -0.0524    0.0433 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3701    0.0177    0.0269 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0320    1.1868   -0.2514 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4230    1.2721   -0.2787 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1877    0.1781   -0.0247 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5377   -1.0024    0.2568 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1384   -1.0817    0.2821 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1021    0.2941   -0.0661 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.2697    1.0377   -0.1014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1111   -1.5299    0.2421 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5317    2.0995   -0.4644 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9220    2.2273   -0.5060 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1482   -1.8675    0.4559 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7339   -2.0564    0.5175 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