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
    1.7467    0.5760    1.1957 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1775    0.1436    0.0326 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2034   -0.3241   -0.9715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1628   -0.2343   -0.5047 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9144   -1.2192    0.1904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5395   -2.3673    0.5381 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2463   -0.6866    0.4570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3299    0.5560   -0.0384 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0441    0.8726   -0.6478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7720    1.9636   -1.2105 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4295    0.9361    1.9806 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6939    0.6049    1.4538 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2194    0.1227   -0.2037 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4490   -1.3455   -1.3498 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3353    0.3402   -1.8764 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0764   -1.1580    0.9635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1694    1.2192   -0.0091 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