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
    2.7226   -1.1168    0.5126 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8464   -0.1619    0.7630 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0952    0.4543   -0.3373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3264    0.3059   -0.2234 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1943   -0.7022   -0.6962 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8005   -1.7055   -1.3455 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5612   -0.3753   -0.3086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5492    0.7626    0.3627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1753    1.2415    0.4506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8411    2.3059    1.0326 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9272   -1.4858   -0.4953 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2654   -1.5583    1.3323 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6975    0.1511    1.7852 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4499    0.0497   -1.3247 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3149    1.5587   -0.4105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4288   -0.9695   -0.5367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4424    1.2456    0.7753 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