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
   -1.1736   -0.6365    2.4067 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7243   -0.4372    1.2829 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1684   -0.5206    1.0394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3611   -0.2520   -0.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0756    0.0191   -0.9025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8788    0.3064   -2.1000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0471   -0.1021    0.0764 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3599    0.0647   -0.0685 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9526    1.2922   -0.2864 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3194    1.4434   -0.4260 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1530    0.3481   -0.3503 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5776   -0.8853   -0.1331 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2102   -1.0203    0.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0444    0.5571   -0.5435 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.9131   -0.7610    1.7946 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3287   -0.2382   -0.7139 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3056    2.1536   -0.3465 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7940    2.4034   -0.5975 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2111   -1.7397   -0.0727 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7429   -1.9949    0.1773 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