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
   -1.6013   -1.0715    2.0398 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9128   -0.3867    1.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2898    0.0053    0.7364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2541    0.7186   -0.3760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8657    0.8350   -0.8557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4773    1.4463   -1.8862 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0310    0.1295    0.0569 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3846   -0.0099   -0.0325 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2093    0.9267   -0.5954 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5851    0.7828   -0.6780 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1235   -0.3762   -0.1570 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3277   -1.3642    0.4284 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9599   -1.1557    0.4778 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0294   -0.5911   -0.2637 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.1944   -0.2349    1.3034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1163    1.1609   -0.8751 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7487    1.8222   -0.9929 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2303    1.5336   -1.1274 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8074   -2.2370    0.8124 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3367   -1.9338    0.9384 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