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
   -2.6879    1.1812   -0.1737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8201    0.3021   -0.6367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1143   -0.6479    0.2610 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3298   -0.4467    0.1704 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2371   -1.0816   -0.7222 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9300   -1.9509   -1.6102 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5657   -0.5534   -0.4288 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4961    0.3335    0.5599 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1015    0.4387    0.9760 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6635    1.1933    1.8990 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2221    1.8881   -0.7881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8953    1.2141    0.8976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6274    0.2842   -1.7013 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2889   -1.7045   -0.0259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4265   -0.4641    1.3015 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4450   -0.8788   -0.9757 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3138    0.8926    0.9973 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