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
    2.7846    0.2888    0.8340 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7445   -0.4889    0.6992 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0248   -0.5619   -0.5910 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3618   -0.1645   -0.4681 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4758   -0.9957   -0.1743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3976   -2.2441    0.0264 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6623   -0.1716   -0.1511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3203    1.0795   -0.4100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8800    1.1499   -0.6196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2104    2.2021   -0.8898 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1280    0.8830    0.0103 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3018    0.3385    1.7686 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4167   -1.0770    1.5394 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0746   -1.6154   -0.9733 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5053    0.0529   -1.3785 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6648   -0.5718    0.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0074    1.8961   -0.4541 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