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
   -2.8894    0.6699   -0.1011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8791    0.2436   -0.8455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9684   -0.7945   -0.3487 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3988   -0.3740   -0.2640 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0902    0.2349    0.8192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5729    0.5102    1.9275 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4579    0.4628    0.3978 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6375    0.0407   -0.8445 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3638   -0.4974   -1.3077 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1199   -1.0029   -2.4531 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5739    1.4253   -0.4301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0507    0.2486    0.8922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7425    0.6779   -1.8253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3154   -1.1641    0.6505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0180   -1.6523   -1.0582 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2644    0.9092    0.9684 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5320    0.0620   -1.4554 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