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
    2.9109   -0.1147    0.4807 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8193    0.6139    0.4136 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9076    0.4961   -0.7846 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4095    0.0715   -0.3815 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9350   -1.2420   -0.2558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2924   -2.2766   -0.4922 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3344   -1.1593    0.1910 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6226    0.1251    0.3227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4630    0.9500   -0.0195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4279    2.2162    0.0090 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5510   -0.0240    1.3347 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1589   -0.7929   -0.3103 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5474    1.3081    1.2032 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8186    1.5185   -1.2005 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3564   -0.1933   -1.5264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9860   -2.0095    0.3712 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5993    0.5131    0.6449 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