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
    1.6620   -1.8681    1.2728 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9705   -0.7956    0.6935 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3151   -0.2317    0.5507 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2668    0.9027   -0.1130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8417    1.1544   -0.4529 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4490    2.1644   -1.0918 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0433    0.0952    0.0518 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3690   -0.0600   -0.0308 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0822    0.6345   -0.9892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4785    0.5090   -1.0699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1600   -0.2982   -0.2071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4647   -0.9990    0.7521 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0928   -0.8660    0.8198 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0716   -0.4629   -0.2684 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.2337   -0.6825    0.9349 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1205    1.5368   -0.3604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5763    1.2807   -1.6867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0192    1.0532   -1.8159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0336   -1.6464    1.4320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5547   -1.4204    1.5785 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