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
   -2.9444   -0.0808    0.0306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8448   -0.7383   -0.2506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8621   -0.1313   -1.1882 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4351    0.0713   -0.5722 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9332    1.2033    0.1369 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2445    2.2568    0.3303 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3095    0.9511    0.5812 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6362   -0.2645    0.1686 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5236   -0.8722   -0.5543 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4711   -2.0134   -1.0871 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1366    0.8779   -0.4050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6643   -0.5055    0.7060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6524   -1.6915    0.1816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7203   -0.8173   -2.0585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2593    0.8171   -1.6226 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9124    1.6565    1.1416 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6186   -0.7194    0.3625 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