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
   -2.8609    0.3381   -0.0673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8113    0.0855    0.6769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8726   -1.0079    0.2774 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4244   -0.3903    0.0828 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9308    0.1514   -1.1141 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3218    0.1872   -2.2379 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2692    0.6714   -0.8779 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5520    0.4536    0.3941 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4383   -0.2097    1.0571 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3795   -0.5647    2.2855 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0387   -0.2377   -0.9529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5522    1.1334    0.2147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6254    0.6672    1.5779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8044   -1.6911    1.1405 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1699   -1.4766   -0.6621 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9321    1.1569   -1.6109 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4873    0.7333    0.8712 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