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
    1.2984    0.5850    2.6485 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7504    0.3464    1.4906 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1782    0.3634    1.1622 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3503    0.0765   -0.1206 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0203   -0.1437   -0.6949 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7418   -0.4377   -1.8849 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0217    0.0230    0.3025 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3954   -0.0772    0.2175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1185    1.1197    0.1875 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4916    1.0374    0.1032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1570   -0.1737    0.0488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3961   -1.3089    0.0818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0174   -1.3066    0.1656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0696   -0.2365   -0.0701 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.9946    0.5786    1.8566 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3019    0.0111   -0.6688 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5816    2.0689    0.2307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0649    1.9736    0.0783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8972   -2.2574    0.0406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4681   -2.2418    0.1889 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