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
   -1.6743    0.2444   -2.2888 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9514   -0.1041   -1.1125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2852   -0.4963   -0.6317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1656   -0.7907    0.6531 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7839   -0.6147    1.0820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3123   -0.8050    2.2330 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0228   -0.1810   -0.0370 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3716    0.1014   -0.0194 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8842    1.3708   -0.2456 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2244    1.6338   -0.2285 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0882    0.5877    0.0248 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6384   -0.6738    0.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2746   -0.9227    0.2319 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9520    0.9312    0.0552 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.1475   -0.5101   -1.2829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9617   -1.1116    1.2953 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1430    2.1505   -0.4374 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5454    2.6376   -0.4127 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2952   -1.5184    0.4554 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8878   -1.9288    0.4127 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