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
    2.8897    0.5636    0.3355 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9228   -0.3364    0.2569 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9173   -0.2880   -0.8376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4277   -0.1420   -0.3448 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3244   -1.1844   -0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0863   -2.4082   -0.0864 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5992   -0.5948    0.4557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4714    0.7349    0.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1200    1.0652   -0.0995 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6355    2.2155   -0.2858 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5991    0.4989    1.1391 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9833    1.3596   -0.3862 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8443   -1.1245    0.9863 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1624    0.5301   -1.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0432   -1.2346   -1.4305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4802   -1.1293    0.7831 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2174    1.4742    0.6675 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