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
   -2.7533   -0.9247    0.4621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8557    0.0649    0.5765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0469    0.4980   -0.5964 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3723    0.3236   -0.3222 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2710    1.2521    0.2564 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9708    2.4280    0.6422 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5900    0.6244    0.3298 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5030   -0.6075   -0.1711 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1318   -0.8583   -0.5996 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6434   -1.9061   -1.1256 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3529   -1.2582    1.2970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9004   -1.4224   -0.4897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7330    0.5416    1.5416 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3466   -0.1091   -1.4553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2882    1.5602   -0.8277 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4826    1.1145    0.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3121   -1.3208   -0.2540 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