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
   -2.9144   -0.1370    0.4256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8263   -0.7302   -0.0343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9099    0.0143   -0.9147 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4202    0.1182   -0.3493 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9464    1.1313    0.4998 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3206    2.1385    0.9132 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3403    0.8355    0.8320 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6377   -0.2927    0.2176 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4946   -0.7962   -0.5348 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4876   -1.8542   -1.2181 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1122    0.8850    0.1469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6316   -0.6333    1.0805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6564   -1.7686    0.2686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3467    0.9966   -1.1774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8792   -0.5543   -1.8912 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0202    1.4176    1.4613 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6092   -0.7705    0.2744 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