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
   -2.9008   -0.5273    0.2331 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8884   -0.0721   -0.5009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9270    0.8911    0.0496 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4442    0.3616    0.0410 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0905   -0.3798    1.0675 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5331   -0.6844    2.1603 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4244   -0.6754    0.5991 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6147   -0.1721   -0.6107 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3808    0.4980   -1.0086 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1760    1.1044   -2.1124 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0576   -0.2096    1.2593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6167   -1.2390   -0.1638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7895   -0.4288   -1.5153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9639    1.8501   -0.5275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2243    1.1586    1.0839 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1692   -1.2295    1.1529 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5355   -0.2457   -1.2074 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