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
    2.9281    0.5307    0.1706 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9210   -0.1490   -0.3524 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8841   -0.8564    0.4456 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4417   -0.3324    0.1571 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3572   -0.7831   -0.8504 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1058   -1.7310   -1.6401 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5735    0.0154   -0.7988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4336    0.9045    0.1714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1239    0.7397    0.8073 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6482    1.4140    1.7688 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9990    0.5726    1.2584 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6248    1.0067   -0.4900 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8367   -0.2002   -1.4269 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1395   -0.7505    1.5220 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9540   -1.9420    0.2219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4423   -0.0899   -1.4343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1611    1.6508    0.4696 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