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
   -2.1766    0.5143   -0.9664 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1421   -0.2380    0.0922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0021   -0.6478    0.8895 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2788   -0.2077    0.5260 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0543    0.9347    0.8732 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6422    1.8135    1.6537 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3190    0.8797    0.1939 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3505   -0.2196   -0.5361 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1092   -0.9414   -0.3731 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8605   -2.0344   -0.9564 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0821    0.7578   -1.4850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2475    0.9160   -1.3453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1170   -0.6183    0.4322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1955   -0.2914    1.9483 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9964   -1.7537    0.9832 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1196    1.6199    0.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2250   -0.4836   -1.1526 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