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
   -2.9471   -0.0302   -0.4745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7795   -0.6448   -0.5383 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8722   -0.7234    0.6177 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4088   -0.1211    0.3886 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8447    1.2066    0.6048 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1098    2.1141    1.0645 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2424    1.3226    0.2132 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6618    0.1284   -0.2263 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5603   -0.8097   -0.1395 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6408   -2.0231   -0.4816 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2402    0.4292    0.4628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6104    0.0274   -1.3192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4910   -1.1006   -1.4717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3312   -0.1693    1.4884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7264   -1.7639    0.9950 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8528    2.2126    0.2621 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6765   -0.0548   -0.5806 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