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
   -2.4980    1.4885   -0.1268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6711    0.6312   -0.6627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2140   -0.6216   -0.0055 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2436   -0.5231    0.1040 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9977    0.0313    1.1911 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4591    0.5181    2.2217 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4148   -0.0816    0.8704 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5263   -0.6567   -0.3138 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2024   -0.9607   -0.8525 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9452   -1.5155   -1.9720 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7805    2.3770   -0.6728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8904    1.2803    0.8802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2789    0.8241   -1.6506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7037   -0.6983    0.9712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4405   -1.4741   -0.6729 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2110    0.2572    1.5136 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4768   -0.8759   -0.8227 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