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
    1.6827   -1.9172   -1.0772 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9792   -0.8703   -0.4872 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3442   -0.4019   -0.1668 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2504    0.7645    0.4708 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8343    1.1071    0.5940 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4040    2.1650    1.1561 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0322    0.0929   -0.0009 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3835    0.0485   -0.0795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0197   -0.9503    0.6550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3853   -1.0814    0.6493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1808   -0.2246   -0.0899 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5373    0.7558   -0.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1559    0.9078   -0.8183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0956   -0.4048   -0.1008 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.2495   -0.9490   -0.4220 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0941    1.3524    0.8362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3847   -1.6306    1.2409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8547   -1.8672    1.2314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1883    1.4189   -1.3857 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6849    1.6845   -1.3955 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