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
   -1.7245    0.6231   -2.3495 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9978    0.2714   -1.1741 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3532    0.0973   -0.6121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2437   -0.2780    0.6514 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8061   -0.3705    0.9844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3738   -0.7072    2.1224 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0464   -0.0255   -0.1621 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3761   -0.0047   -0.2073 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0877    1.1723    0.0119 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4433    1.2509   -0.0207 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1441    0.0950   -0.2874 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4913   -1.0916   -0.5115 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1200   -1.1329   -0.4698 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0534    0.1389   -0.3486 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.2961    0.2409   -1.1125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0608   -0.4835    1.3261 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5194    2.0806    0.2209 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9877    2.1907    0.1549 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0846   -1.9985   -0.7228 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5950   -2.0689   -0.6473 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