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
    2.0572    0.7706    0.4088 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0813   -0.4751   -0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8657   -1.2490   -0.3687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3317   -0.4525   -0.2022 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9366    0.3720   -1.1846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5478    0.5655   -2.3805 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1009    0.9522   -0.5319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2068    0.5392    0.7037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1014   -0.3621    0.9697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8870   -0.9588    2.0867 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9684    1.2765    0.6550 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1361    1.3411    0.5227 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0393   -0.9696   -0.0924 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9178   -1.6506   -1.3749 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8054   -2.1216    0.3353 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8000    1.6392   -0.9956 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9590    0.7831    1.4560 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