Monomers

N-Benzylmaleimide

Identifiers

IUPAC name
1-benzylpyrrole-2,5-dione
InchI
InChI=1S/C11H9NO2/c13-10-6-7-11(14)12(10)8-9-4-2-1-3-5-9/h1-7H,8H2
InchI Key
MKRBAPNEJMFMHU-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1Cc1ccccc1
Canonical SMILES
C1=CC=C(C=C1)CN2C(=O)C=CC2=O
Isomeric SMILES
C1=CC=C(C=C1)CN2C(=O)C=CC2=O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C11H9NO2
Heavy Atom Count
14
Molecular Weight
187.198
Exact Molecular Weight
187.0633
Valence Electrons
70
Radical Electrons
0
tPSA
37.38
MolLogP
1.1116
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

 23 24  0  0  0  0  0  0  0  0999 V2000
    1.9784   -1.0971   -1.7193 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2339   -0.4831   -0.6520 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3751    0.4177   -0.4210 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3421    0.8928    0.8061 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1728    0.3310    1.4588 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8182    0.5655    2.6536 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4880   -0.5204    0.5547 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2961   -1.2932    0.7271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9336   -0.5615    0.3721 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1730   -1.1504    0.4770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3374   -0.4689    0.1447 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2814    0.8281   -0.3033 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0532    1.4373   -0.4162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9191    0.7385   -0.0803 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1515    0.6721   -1.1466 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0824    1.5823    1.2148 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3320   -2.1968    0.0645 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1999   -1.6557    1.7737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2880   -2.1646    0.8215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3228   -0.9433    0.2302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1932    1.3607   -0.5631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0237    2.4685   -0.7735 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0550    1.2403   -0.1763 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  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
  7  2  1  0
 14  9  1  0
  3 15  1  0
  4 16  1  0
  8 17  1  0
  8 18  1  0
 10 19  1  0
 11 20  1  0
 12 21  1  0
 13 22  1  0
 14 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers