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
    1.8139   -1.3317   -1.7624 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9905   -0.6033   -0.7610 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3512   -0.2633   -0.2783 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2454    0.5036    0.7756 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8060    0.7196    1.0538 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4401    1.4218    2.0126 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0334    0.0288    0.0964 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3750   -0.0263   -0.0239 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0042   -0.4457   -1.1841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3665   -0.4809   -1.2932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1882   -0.0991   -0.2463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5898    0.3226    0.9199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1924    0.3557    1.0226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0920   -0.1574   -0.4298 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.2560   -0.6117   -0.7506 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0811    0.9011    1.3435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4116   -0.7446   -2.0098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8771   -0.8037   -2.2117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1839    0.6256    1.7695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7369    0.6887    1.9572 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