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
   -2.8471   -0.3936    0.2586 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8294    0.4160    0.5119 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8589    0.7560   -0.5923 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4350    0.2948   -0.1332 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4371    0.9602    0.6081 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3441    2.1670    1.0148 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5612    0.0521    0.8194 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2472   -1.0784    0.2415 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9284   -1.0156   -0.3823 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3365   -1.9428   -1.0204 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9838   -0.8057   -0.7204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5257   -0.6131    1.0875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6501    0.8545    1.4784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8607    1.8532   -0.7811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1028    0.1854   -1.5106 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4943    0.2665    1.3579 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8745   -1.9564    0.2203 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