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
   -1.5766   -1.2408    1.9846 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9348   -0.6744    0.9138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3271   -0.5396    0.4655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3110    0.1047   -0.6861 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9124    0.4261   -1.0562 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6060    1.0319   -2.1006 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0486   -0.0695   -0.0380 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3791    0.0290    0.0046 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0743    0.9245   -0.7807 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4715    1.0139   -0.7286 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1980    0.2116    0.1097 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5234   -0.6887    0.9008 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1264   -0.7697    0.8394 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1205    0.3324    0.1836 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.2207   -0.9062    0.9981 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1857    0.3536   -1.2623 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5189    1.5614   -1.4418 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0025    1.7161   -1.3423 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0745   -1.3236    1.5654 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6337   -1.4927    1.4710 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