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
   -2.8764    0.3467    0.3751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8763   -0.0373   -0.4114 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8686   -1.0213    0.0269 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4300   -0.3795   -0.0217 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0436    0.3408    1.0446 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5673    0.5373    2.1908 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3427    0.8347    0.6091 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5132    0.4423   -0.6425 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3502   -0.3260   -1.1046 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1840   -0.8512   -2.2561 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9520   -0.0801    1.3739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5923    1.0686    0.0165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7752    0.3711   -1.4125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0793   -1.4184    1.0418 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8381   -1.8727   -0.7149 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0555    1.4143    1.1763 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3717    0.6306   -1.2914 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