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
    2.7854    0.6931    0.8850 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6853    0.9718    0.1892 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0233   -0.0339   -0.6747 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3474   -0.2593   -0.2192 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7879   -1.2126    0.7268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0835   -2.0407    1.3496 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2246   -1.0614    0.8525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6556   -0.0826    0.0429 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4936    0.4568   -0.6595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5458    1.3940   -1.5007 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2258    1.4656    1.4989 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2280   -0.2822    0.8374 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2313    1.9566    0.2321 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5809   -0.9786   -0.7485 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9561    0.4112   -1.6911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8876   -1.6261    1.4865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6901    0.2283   -0.0500 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