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
    1.9230   -1.9739   -0.7392 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0381   -0.7661   -0.4032 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3355   -0.0729   -0.3048 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1604    1.1801    0.0671 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7304    1.3698    0.2314 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2009    2.4579    0.5842 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0253    0.1696   -0.0576 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3700   -0.0823   -0.0213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1373    0.5257    0.9621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5113    0.3212    1.0540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1524   -0.5043    0.1559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3922   -1.1060   -0.8169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0251   -0.9061   -0.9136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0318   -0.8448    0.2213 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.3200   -0.5194   -0.5116 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9484    1.9288    0.2249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6443    1.1608    1.6577 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1125    0.7861    1.8060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8872   -1.7510   -1.5199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4181   -1.3734   -1.6766 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