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
   -2.7076    0.9218   -0.7595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9144   -0.1361   -0.6314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0517   -0.2257    0.5388 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3570   -0.2881    0.2444 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1827    0.8657    0.1299 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8144    2.0823    0.2656 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5505    0.4566   -0.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5592   -0.8617   -0.2392 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2096   -1.3923    0.0141 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8533   -2.5769    0.0299 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7329    1.7307   -0.0105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3872    1.0793   -1.5969 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9768   -0.8651   -1.4306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2395    0.6383    1.2020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3849   -1.1232    1.1362 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4133    1.1244   -0.3189 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4551   -1.4301   -0.4523 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