Monomers

N-Vinylphthalimide

Identifiers

IUPAC name
2-ethenylisoindole-1,3-dione
InchI
InChI=1S/C10H7NO2/c1-2-11-9(12)7-5-3-4-6-8(7)10(11)13/h2-6H,1H2
InchI Key
IGDLZDCWMRPMGL-UHFFFAOYSA-N
SMILES
C=CN1C(=O)c2c(C1=O)cccc2
Canonical SMILES
C=CN1C(=O)C2=CC=CC=C2C1=O
Isomeric SMILES
C=CN1C(=O)C2=CC=CC=C2C1=O
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C10H7NO2
Heavy Atom Count
13
Molecular Weight
173.171
Exact Molecular Weight
173.0477
Valence Electrons
64
Radical Electrons
0
tPSA
37.38
MolLogP
1.4261
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1

MOL File


     RDKit          3D

 20 21  0  0  0  0  0  0  0  0999 V2000
    3.7005   -0.7149    0.0157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9167    0.2677   -0.3380 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5177    0.1822   -0.2637 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6314    1.2598   -0.6508 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9929    2.3921   -1.0960 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7155    0.7766   -0.4254 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6654   -0.5029    0.0640 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7460   -0.9147    0.1801 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1019   -2.0575    0.6080 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8249   -1.2177    0.3727 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0306   -0.5892    0.1674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1271    0.6960   -0.3229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9556    1.3614   -0.6130 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8023   -0.6311   -0.0491 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2797   -1.6383    0.3825 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4150    1.1805   -0.7030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7771   -2.2196    0.7557 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9224   -1.1421    0.4060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0941    1.1543   -0.4700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9915    2.3577   -0.9942 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  2  0
  4  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  7 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
  8  3  1  0
 13  6  1  0
  1 14  1  0
  1 15  1  0
  2 16  1  0
 10 17  1  0
 11 18  1  0
 12 19  1  0
 13 20  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers