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
    3.8684    0.8723   -0.4427 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6073    0.0726   -0.2531 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5036   -1.2349   -0.2306 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1012   -1.5682   -0.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5884   -2.7348    0.0587 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3683   -0.3756    0.0778 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3030    0.6869   -0.0652 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0296    1.9312   -0.0318 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0333   -0.1748    0.2805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7419   -0.6815    1.3458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1046   -0.4588    1.4999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7918    0.2991    0.5557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0958    0.8105   -0.5120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7461    0.5819   -0.6516 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0422    1.4566    0.4704 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6869    0.2069   -0.7344 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6639    1.5749   -1.2894 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3090   -1.9705   -0.3450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2217   -1.2678    2.0815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6566   -0.8610    2.3434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8544    0.4540    0.7025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6343    1.3956   -1.2384 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1915    0.9856   -1.4968 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