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
   -2.8846    0.5969   -0.2496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9007   -0.2455    0.0071 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9158   -0.5451   -1.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4312   -0.1892   -0.6563 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2987   -1.0915    0.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0607   -2.2865    0.3517 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5562   -0.3975    0.2385 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4652    0.8288   -0.2442 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1454    1.0234   -0.8237 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7036    2.0619   -1.3729 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9688    1.0631   -1.2209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6499    0.8675    0.4771 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8520   -0.6953    1.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2213    0.0006   -1.9789 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9650   -1.6607   -1.2314 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4151   -0.8657    0.7403 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2821    1.5347   -0.1871 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