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
   -1.1179    0.6657   -2.4809 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6850    0.3378   -1.4122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1298    0.2272   -1.2644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3635   -0.1358   -0.0146 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0873   -0.2779    0.7068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9201   -0.6081    1.9082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0267    0.0259   -0.1927 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3665    0.0131    0.0893 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9448    0.7664    1.0918 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3038    0.7344    1.3442 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1463   -0.0608    0.5957 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5764   -0.8166   -0.4080 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2179   -0.7799   -0.6548 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0332   -0.1058    0.9455 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.8981    0.4065   -2.0319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3417   -0.3022    0.4110 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2820    1.3917    1.6803 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7424    1.3392    2.1436 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1983   -1.4444   -1.0082 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7583   -1.3762   -1.4486 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