Monomers

2-Methyl-N-phenylmaleimide

Identifiers

IUPAC name
3-methyl-1-phenylpyrrole-2,5-dione
InchI
InChI=1S/C11H9NO2/c1-8-7-10(13)12(11(8)14)9-5-3-2-4-6-9/h2-7H,1H3
InchI Key
QAVUFFJVZGZJMO-UHFFFAOYSA-N
SMILES
CC1=CC(=O)N(C1=O)c1ccccc1
Canonical SMILES
CC1=CC(=O)N(C1=O)C2=CC=CC=C2
Isomeric SMILES
CC1=CC(=O)N(C1=O)C2=CC=CC=C2
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
1.5061
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
    3.9710   -0.1119    0.3741 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6312    0.0766   -0.2386 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4169    0.4424   -1.5015 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9491    0.5090   -1.6926 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3413    0.8204   -2.7546 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2883    0.1652   -0.4825 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3545   -0.1117    0.4512 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2186   -0.4546    1.6453 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0970    0.0727   -0.1771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0036    1.0803   -0.4463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3479    0.8888   -0.1147 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7756   -0.2884    0.4748 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8766   -1.2960    0.7460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5752   -1.1021    0.4214 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4207   -1.0837    0.0821 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6359    0.7384    0.1072 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8662   -0.0865    1.4907 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1193    0.6627   -2.2925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6870    2.0111   -0.9081 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0500    1.6643   -0.3240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8033   -0.4787    0.7432 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1466   -2.2376    1.2045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8503   -1.8806    0.6274 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  6  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
  1 15  1  0
  1 16  1  0
  1 17  1  0
  3 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