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
    1.2399   -0.4700    2.5217 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7518   -0.3905    1.3595 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1334   -0.7323    1.0138 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3165   -0.5267   -0.2786 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0526   -0.0343   -0.8580 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9087    0.2559   -2.0860 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1036    0.0380    0.1840 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2387    0.4685    0.1037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5495    1.8268   -0.0467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8551    2.2341   -0.1212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9176    1.3377   -0.0536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6323    0.0082    0.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3009   -0.3993    0.1684 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0145   -1.8577    0.3146 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8774   -1.0922    1.7020 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2236   -0.6815   -0.8515 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2983    2.4916   -0.0953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0330    3.3116   -0.2392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9308    1.7201   -0.1180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3936   -0.7502    0.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0582   -2.0964    0.7612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1610   -2.3691   -0.6757 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8206   -2.2924    0.9825 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