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
    3.9647    0.1456   -0.8260 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6313   -0.2558   -0.3065 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3981   -1.2602    0.5069 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9460   -1.3105    0.7726 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4050   -2.1628    1.5150 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3184   -0.2504    0.0502 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3651    0.4251   -0.6364 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2646    1.4192   -1.3934 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0813    0.0625    0.0012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9986   -0.7688    0.5976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3499   -0.4419    0.5189 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8014    0.6815   -0.1345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8687    1.4999   -0.7231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5233    1.1703   -0.6412 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4798   -0.7811   -1.2209 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5403    0.5239    0.0367 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9241    0.8384   -1.6681 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1381   -1.9388    0.9195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7344   -1.6833    1.1384 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0609   -1.1268    1.0045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8700    0.9317   -0.1955 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2127    2.3846   -1.2403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8743    1.8977   -1.1426 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