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
   -1.9145   -0.7435    0.6551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1290    0.2216   -0.2367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9837    0.9178   -0.8705 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2704    0.3776   -0.3629 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9642    0.8668    0.7777 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5945    1.8362    1.5121 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1499    0.0320    0.9041 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2086   -0.8811   -0.0409 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0317   -0.7108   -0.8845 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7235   -1.4000   -1.9060 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7358   -1.2664    1.1314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9189   -1.0490    0.9443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1417    0.4900   -0.4917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0129    2.0173   -0.6141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9513    0.7939   -1.9683 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8894    0.1482    1.6777 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9557   -1.6505   -0.2268 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