Monomers

3-Methylidene-1-propan-2-ylpyrrolidine-2,5-dione

Identifiers

IUPAC name
3-methylidene-1-propan-2-ylpyrrolidine-2,5-dione
InchI
InChI=1S/C8H11NO2/c1-5(2)9-7(10)4-6(3)8(9)11/h5H,3-4H2,1-2H3
InchI Key
DBKRPGDEXPANMB-UHFFFAOYSA-N
SMILES
CC(N1C(=O)CC(=C)C1=O)C
Canonical SMILES
CC(C)N1C(=O)CC(=C)C1=O
Isomeric SMILES
CC(C)N1C(=O)CC(=C)C1=O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H11NO2
Heavy Atom Count
11
Molecular Weight
153.181
Exact Molecular Weight
153.079
Valence Electrons
60
Radical Electrons
0
tPSA
37.38
MolLogP
0.7099
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

 22 22  0  0  0  0  0  0  0  0999 V2000
   -2.1379   -0.7959   -0.7995 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5908   -0.0836    0.4440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1625   -0.1876    0.5190 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6459   -0.8184    1.5159 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1848   -1.1853    2.6291 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0362   -0.9361    0.9924 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0976    0.0745   -0.0747 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1885    0.6071   -0.5775 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7217    0.3576   -0.4520 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4276    1.0034   -1.5096 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0750    1.3339    0.3841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2134   -0.5196   -0.8465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0185   -1.9053   -0.6848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6540   -0.4231   -1.7230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0945   -0.5776    1.3032 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2431   -1.9608    0.6117 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7188   -0.7037    1.8410 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1452    0.3107   -0.2096 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1836    1.3507   -1.3654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1272    1.3464    0.7401 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0643    1.7519   -0.6441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4549    1.9605    1.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  3
  7  9  1  0
  9 10  2  0
  2 11  1  0
  9  3  1  0
  1 12  1  0
  1 13  1  0
  1 14  1  0
  2 15  1  0
  6 16  1  0
  6 17  1  0
  8 18  1  0
  8 19  1  0
 11 20  1  0
 11 21  1  0
 11 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers