Monomers

MALEIMIDE, N-o-TOLYL-

Identifiers

IUPAC name
1-(2-methylphenyl)pyrrole-2,5-dione
InchI
InChI=1S/C11H9NO2/c1-8-4-2-3-5-9(8)12-10(13)6-7-11(12)14/h2-7H,1H3
InchI Key
QYOJZFBQEAZNEW-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1c1ccccc1C
Canonical SMILES
CC1=CC=CC=C1N2C(=O)C=CC2=O
Isomeric SMILES
CC1=CC=CC=C1N2C(=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
1.4244
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
    1.3020    1.5410   -1.7765 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7655    1.0021   -0.7307 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0879    1.2262   -0.1210 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2306    0.4908    0.9682 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0017   -0.2562    1.1281 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7656   -1.0671    2.0583 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0770    0.0526    0.0746 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2219   -0.5038   -0.0755 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4291   -1.8723   -0.1731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6935   -2.4044   -0.3191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8001   -1.5850   -0.3726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5843   -0.2269   -0.2750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3169    0.3309   -0.1276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1172    1.7928   -0.0275 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7970    1.9078   -0.5500 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1209    0.4800    1.5932 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4674   -2.5004   -0.1253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8427   -3.4675   -0.3968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8120   -1.9634   -0.4863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4037    0.4923   -0.3083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1866    2.0709    0.4764 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2506    2.2353   -1.0277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9570    2.2243    0.5941 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  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 13 14  1  0
  7  2  1  0
 13  8  1  0
  3 15  1  0
  4 16  1  0
  9 17  1  0
 10 18  1  0
 11 19  1  0
 12 20  1  0
 14 21  1  0
 14 22  1  0
 14 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers