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
    3.9232    0.8426    0.3370 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6546    0.1389   -0.0094 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5145   -1.0249   -0.6177 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0868   -1.3667   -0.7706 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5825   -2.3970   -1.3017 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3399   -0.3080   -0.2009 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3159    0.6296    0.2731 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0055    1.7048    0.8430 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0704   -0.1571   -0.0933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6176    0.1064    1.1546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9807    0.2602    1.3086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8545    0.1614    0.2465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3037   -0.1014   -0.9953 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9269   -0.2603   -1.1714 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8045    1.4135    1.3037 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0969    1.5989   -0.4536 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7657    0.1573    0.5003 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3261   -1.6687   -0.9713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9170    0.1826    1.9951 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3795    0.4653    2.2931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9261    0.2753    0.3285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9551   -0.1873   -1.8625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4846   -0.4656   -2.1357 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