Monomers

N-Allylmaleimide

Identifiers

IUPAC name
1-prop-2-enylpyrrole-2,5-dione
InchI
InChI=1S/C7H7NO2/c1-2-5-8-6(9)3-4-7(8)10/h2-4H,1,5H2
InchI Key
PSFDAYXWBWRTSM-UHFFFAOYSA-N
SMILES
C=CCN1C(=O)C=CC1=O
Canonical SMILES
C=CCN1C(=O)C=CC1=O
Isomeric SMILES
C=CCN1C(=O)C=CC1=O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H7NO2
Heavy Atom Count
10
Molecular Weight
137.138
Exact Molecular Weight
137.0477
Valence Electrons
52
Radical Electrons
0
tPSA
37.38
MolLogP
0.0974
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0

MOL File


     RDKit          3D

 17 17  0  0  0  0  0  0  0  0999 V2000
   -2.7182    1.1146   -0.4204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9219    0.0704   -0.4742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0643   -0.3176    0.6959 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3443   -0.2956    0.3418 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2654    0.7884    0.4358 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9501    1.9267    0.8630 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5858    0.3825   -0.0260 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5084   -0.8922   -0.3942 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1410   -1.3645   -0.1876 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6515   -2.5085   -0.4105 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7640    1.7055    0.4679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3151    1.3637   -1.2697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8471   -0.5497   -1.3500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2272    0.4452    1.5070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3860   -1.2838    1.1007 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5058    0.9502   -0.0889 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2915   -1.5354   -0.7905 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
  9  4  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  3 14  1  0
  3 15  1  0
  7 16  1  0
  8 17  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers