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
    1.5956   -2.2541    0.9956 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9344   -1.1379    0.5087 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2683   -0.5533    0.4607 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2610    0.6244   -0.1178 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8973    0.9038   -0.4991 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4850    1.9314   -1.0769 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0558   -0.1841   -0.1172 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3407   -0.2910   -0.3259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8297   -1.1430   -1.2959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1951   -1.2240   -1.4865 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0978   -0.4860   -0.7431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5957    0.3586    0.2193 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2131    0.4520    0.4235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6731    1.3583    1.4644 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1645   -1.0467    0.8630 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1180    1.2513   -0.2697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1027   -1.7206   -1.8831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5873   -1.8860   -2.2432 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1614   -0.5979   -0.9390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2637    0.9527    0.8234 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4320    1.3956    1.4032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1441    2.3739    1.3824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0072    0.9227    2.4533 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