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
   -1.3025    2.4852   -0.0084 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7901    1.3301    0.0556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2355    1.0179    0.1423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3502   -0.2968    0.1926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0097   -0.9228    0.1426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8049   -2.1644    0.1731 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0506    0.1170    0.0561 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3749   -0.0528   -0.0129 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9883   -1.1947    0.4564 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3771   -1.3368    0.3792 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1845   -0.3599   -0.1599 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5741    0.7834   -0.6299 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1809    0.9251   -0.5522 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0770   -0.5209   -0.2818 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -4.0139    1.7669    0.1595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2971   -0.8184    0.2614 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3928   -1.9637    0.8806 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8649   -2.2327    0.7472 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1264    1.6012   -1.0697 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7135    1.8371   -0.9319 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