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
    2.9184   -0.1710    0.3440 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8176   -0.6689   -0.1578 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8073    0.2434   -0.7412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4652    0.1644   -0.0868 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5428   -0.6863   -0.4050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6252   -1.5560   -1.3249 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6232   -0.4154    0.5269 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2243    0.5460    1.3642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8561    0.9517    1.0175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1884    1.8508    1.6287 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0874    0.8884    0.3327 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6636   -0.8146    0.7717 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6846   -1.7518   -0.1265 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7227   -0.0064   -1.8283 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1995    1.2868   -0.6579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6025   -0.8560    0.6078 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7733    0.9948    2.1839 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