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
    2.7881    0.1842    0.8662 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8896   -0.3096    0.0400 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9553    0.5463   -0.7436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4019    0.1945   -0.3718 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2035    0.7480    0.6644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8488    1.6632    1.4504 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4956    0.0565    0.6358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5033   -0.8478   -0.3301 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2094   -0.8076   -1.0012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8212   -1.5152   -1.9746 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8781    1.2469    1.0047 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4479   -0.4584    1.4174 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8250   -1.3849   -0.0766 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1931    1.6004   -0.4851 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1597    0.3422   -1.8129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3209    0.2562    1.3055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3321   -1.5149   -0.5884 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