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
    1.8033    0.0227   -1.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1622   -0.2584    0.0583 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1157   -0.3228    1.0846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2037   -0.0587    0.5431 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8893    1.1825    0.4100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3983    2.2943    0.7740 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1923    0.9275   -0.1941 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3412   -0.3654   -0.4328 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1149   -1.0361    0.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8376   -2.2647   -0.0303 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5651    0.0748   -1.9768 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7782    0.2003   -1.4756 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1815   -0.4362    0.3369 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1436   -1.2698    1.6781 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3268    0.4864    1.8312 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9111    1.7097   -0.4034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1880   -0.8861   -0.8730 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