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
   -1.5211    0.0404   -2.2452 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8807   -0.1601   -1.0618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2517   -0.4384   -0.6551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2776   -0.6001    0.6711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9243   -0.4329    1.1787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5600   -0.5141    2.3812 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0360   -0.1537    0.0807 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3655    0.0712    0.1687 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2058   -0.4009   -0.8175 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5773   -0.2006   -0.7658 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1449    0.4854    0.2879 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3173    0.9685    1.2904 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9475    0.7549    1.2153 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0393    0.7852    0.4001 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.1408   -0.5133   -1.2848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1544   -0.8176    1.2630 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8093   -0.9514   -1.6751 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2533   -0.5619   -1.5275 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7824    1.5090    2.1154 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3042    1.1303    1.9940 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