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
    2.9151   -0.3244    0.5087 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8932    0.4802    0.2571 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9489    0.2374   -0.8455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4155    0.0718   -0.3761 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4017    1.0722   -0.1931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2030    2.2961   -0.4290 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6473    0.4513    0.3010 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4226   -0.8442    0.4084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0379   -1.1522   -0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4934   -2.2892   -0.0210 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0988   -1.2147   -0.1038 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5906   -0.1128    1.3309 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7349    1.3519    0.8770 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2403   -0.6009   -1.5019 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9417    1.1490   -1.4925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5683    0.9751    0.5291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1737   -1.5467    0.7521 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