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
   -1.7524   -0.3062   -2.1576 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0083   -0.0393   -0.9429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3205    0.1714   -0.3395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2242    0.4315    0.9537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7996    0.3995    1.2542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3305    0.6054    2.4043 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0329    0.1092    0.0902 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3780   -0.0147   -0.0597 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1090   -0.6547    0.9211 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4784   -0.7979    0.8173 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1772   -0.3089   -0.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4491    0.3305   -1.2495 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0656    0.4784   -1.1506 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0748   -0.5204   -0.3891 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.2748    0.1267   -0.8613 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0590    0.6280    1.6412 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5530   -1.0421    1.7825 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0219   -1.2973    1.5900 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9878    0.7275   -2.1241 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5073    0.9734   -1.9113 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