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
    1.8345   -0.0666    2.1418 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0235   -0.0881    0.8998 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3413   -0.1623    0.2647 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2285   -0.1675   -1.0583 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8021   -0.0952   -1.3464 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2694   -0.0766   -2.4822 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0499   -0.0457   -0.1271 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3662    0.0321    0.0322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0156    1.2068    0.3478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3884    1.2814    0.5212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1881    0.1613    0.3822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5416   -1.0180    0.0645 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1762   -1.0887   -0.1056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0674    0.1971    0.6193 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.2964   -0.2095    0.7877 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0332   -0.2200   -1.7974 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4149    2.1024    0.4655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9064    2.2059    0.7726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1570   -1.9216   -0.0371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6570   -2.0273   -0.3452 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