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
    2.8776    0.1208    0.3797 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8822   -0.5993   -0.0989 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9300    0.0255   -1.0275 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4255    0.0152   -0.5458 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4544   -0.9508   -0.7179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3479   -2.0361   -1.3661 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6516   -0.4917   -0.0286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3721    0.6639    0.5200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9951    1.0500    0.2408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4368    2.1124    0.6366 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5851   -0.3239    1.0627 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0075    1.1583    0.1040 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8103   -1.6414    0.2214 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0383   -0.4936   -2.0049 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2213    1.0699   -1.2053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6236   -0.9689    0.0535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0453    1.2897    1.1142 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