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
    2.0470    1.4258   -1.4083 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6299    0.3020   -0.8478 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2517   -0.1937   -1.0245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4625   -0.3197    0.2214 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2591    0.6456    0.8779 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4684    1.8010    0.4529 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7943    0.0687    2.1313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3273   -1.1612    2.1864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4904   -1.4782    1.0345 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1002   -2.5759    0.8009 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3546    1.9871   -2.0082 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0520    1.7886   -1.2804 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3251   -0.2625   -0.2450 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3013   -1.1956   -1.5120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3000    0.4540   -1.7628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4381    0.5968    2.8291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5219   -1.8827    2.9813 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