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
    2.5702    1.4567    0.0946 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8066    0.5920   -0.5339 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1397   -0.4811    0.2394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3002   -0.4320    0.1360 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2529    0.2383    0.9235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9842    0.9492    1.9092 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5748   -0.0350    0.4013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4264   -0.8285   -0.6463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0208   -1.1237   -0.8772 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5391   -1.8585   -1.8067 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7004    1.3757    1.1516 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0610    2.2403   -0.4490 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6514    0.6438   -1.6071 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3887   -0.4126    1.3134 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5050   -1.4505   -0.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5099    0.3589    0.8200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2149   -1.2331   -1.2821 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