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
   -2.8792   -0.4935    0.4843 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9017    0.3708    0.2378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9521    0.1920   -0.9012 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4176    0.0897   -0.3875 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3231    1.1662   -0.1732 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0761    2.3866   -0.3974 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5811    0.6298    0.3471 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4446   -0.6819    0.4406 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1196   -1.0916   -0.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6312   -2.2705   -0.0508 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9660   -1.3450   -0.1781 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5322   -0.3093    1.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7577    1.2601    0.8745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2064   -0.7905   -1.3904 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0678    0.9994   -1.6241 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4552    1.2424    0.6007 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2148   -1.3549    0.7968 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